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Drug Standards

Drug Standards

Standard-value, reference solutions designed to facilitate accurate chromatographic and mass spectrometry-based toxicology and forensic detection of drugs and pharmaceuticals.
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1 – 15 of 346 results
1

Thermo Scientific Acros Oxfendazole, Thermo Scientific™

CAS: 53716-50-0 Molecular Formula: C15H13N3O3S Molecular Weight (g/mol): 315.35 MDL Number: 00801063 InChI Key: BEZZFPOZAYTVHN-UHFFFAOYNA-N IUPAC Name: methyl N-[6-(benzenesulfinyl)-1H-1,3-benzodiazol-2-yl]carbamate SMILES: COC(=O)NC1=NC2=CC=C(C=C2N1)S(=O)C1=CC=CC=C1

CAS 53716-50-0
Molecular Weight (g/mol) 315.35
MDL Number 00801063
SMILES COC(=O)NC1=NC2=CC=C(C=C2N1)S(=O)C1=CC=CC=C1
IUPAC Name methyl N-[6-(benzenesulfinyl)-1H-1,3-benzodiazol-2-yl]carbamate
InChI Key BEZZFPOZAYTVHN-UHFFFAOYNA-N
Molecular Formula C15H13N3O3S
2

Thermo Scientific Chemicals Vandetanib

CAS: 443913-73-3 Molecular Formula: C22H24BrFN4O2 Molecular Weight (g/mol): 475.36 InChI Key: UHTHHESEBZOYNR-UHFFFAOYSA-N IUPAC Name: N-(4-bromo-2-fluorophenyl)-6-methoxy-7-[(1-methylpiperidin-4-yl)methoxy]quinazolin-4-amine SMILES: COC1=C(OCC2CCN(C)CC2)C=C2N=CN=C(NC3=CC=C(Br)C=C3F)C2=C1

CAS 443913-73-3
Molecular Weight (g/mol) 475.36
SMILES COC1=C(OCC2CCN(C)CC2)C=C2N=CN=C(NC3=CC=C(Br)C=C3F)C2=C1
IUPAC Name N-(4-bromo-2-fluorophenyl)-6-methoxy-7-[(1-methylpiperidin-4-yl)methoxy]quinazolin-4-amine
InChI Key UHTHHESEBZOYNR-UHFFFAOYSA-N
Molecular Formula C22H24BrFN4O2
3

Thermo Scientific Acros Etravirine, Thermo Scientific™

CAS: 269055-15-4 Molecular Formula: C20H15BrN6O Molecular Weight (g/mol): 435.29 MDL Number: MFCD09837879 InChI Key: PYGWGZALEOIKDF-UHFFFAOYSA-N Synonym: 4-((6-Amino-5-bromo-2-((4-cyanophenyl)amino)pyrimidin-4-yl)oxy)-3,5-dimethylbenzonitrile IUPAC Name: 4-({6-amino-5-bromo-2-[(4-cyanophenyl)amino]pyrimidin-4-yl}oxy)-3,5-dimethylbenzonitrile SMILES: CC1=CC(=CC(C)=C1OC1=NC(NC2=CC=C(C=C2)C#N)=NC(N)=C1Br)C#N

CAS 269055-15-4
Molecular Weight (g/mol) 435.29
MDL Number MFCD09837879
SMILES CC1=CC(=CC(C)=C1OC1=NC(NC2=CC=C(C=C2)C#N)=NC(N)=C1Br)C#N
Synonym 4-((6-Amino-5-bromo-2-((4-cyanophenyl)amino)pyrimidin-4-yl)oxy)-3,5-dimethylbenzonitrile
IUPAC Name 4-({6-amino-5-bromo-2-[(4-cyanophenyl)amino]pyrimidin-4-yl}oxy)-3,5-dimethylbenzonitrile
InChI Key PYGWGZALEOIKDF-UHFFFAOYSA-N
Molecular Formula C20H15BrN6O
6

Thermo Scientific Acros Fenticonazole nitrate, Thermo Scientific™

CAS: 73151-29-8 Molecular Formula: C24H21Cl2N3O4S Molecular Weight (g/mol): 518.41 MDL Number: 00941391 InChI Key: FJNRUWDGCVDXLU-UHFFFAOYNA-N IUPAC Name: 1-[2-(2,4-dichlorophenyl)-2-{[4-(phenylsulfanyl)phenyl]methoxy}ethyl]-1H-imidazole; nitric acid SMILES: O[N+]([O-])=O.ClC1=CC=C(C(CN2C=CN=C2)OCC2=CC=C(SC3=CC=CC=C3)C=C2)C(Cl)=C1

CAS 73151-29-8
Molecular Weight (g/mol) 518.41
MDL Number 00941391
SMILES O[N+]([O-])=O.ClC1=CC=C(C(CN2C=CN=C2)OCC2=CC=C(SC3=CC=CC=C3)C=C2)C(Cl)=C1
IUPAC Name 1-[2-(2,4-dichlorophenyl)-2-{[4-(phenylsulfanyl)phenyl]methoxy}ethyl]-1H-imidazole; nitric acid
InChI Key FJNRUWDGCVDXLU-UHFFFAOYNA-N
Molecular Formula C24H21Cl2N3O4S
8

Thermo Scientific Acros Bromfenac sodium, Thermo Scientific™

CAS: 91714-93-1 Molecular Formula: C15H11BrNNaO3 Molecular Weight (g/mol): 356.15 MDL Number: MFCD03701673 InChI Key: HZFGMQJYAFHESD-UHFFFAOYSA-M IUPAC Name: sodium 2-[2-amino-3-(4-bromobenzoyl)phenyl]acetate SMILES: [Na+].NC1=C(CC([O-])=O)C=CC=C1C(=O)C1=CC=C(Br)C=C1

CAS 91714-93-1
Molecular Weight (g/mol) 356.15
MDL Number MFCD03701673
SMILES [Na+].NC1=C(CC([O-])=O)C=CC=C1C(=O)C1=CC=C(Br)C=C1
IUPAC Name sodium 2-[2-amino-3-(4-bromobenzoyl)phenyl]acetate
InChI Key HZFGMQJYAFHESD-UHFFFAOYSA-M
Molecular Formula C15H11BrNNaO3
9

Thermo Scientific Acros Oxibendazole, Thermo Scientific™

CAS: 20559-55-1 Molecular Formula: C12H15N3O3 Molecular Weight (g/mol): 249.27 MDL Number: 00133728 InChI Key: RAOCRURYZCVHMG-UHFFFAOYSA-N IUPAC Name: methyl N-(6-propoxy-1H-1,3-benzodiazol-2-yl)carbamate SMILES: CCCOC1=CC=C2N=C(NC(=O)OC)NC2=C1

CAS 20559-55-1
Molecular Weight (g/mol) 249.27
MDL Number 00133728
SMILES CCCOC1=CC=C2N=C(NC(=O)OC)NC2=C1
IUPAC Name methyl N-(6-propoxy-1H-1,3-benzodiazol-2-yl)carbamate
InChI Key RAOCRURYZCVHMG-UHFFFAOYSA-N
Molecular Formula C12H15N3O3
10

Thermo Scientific Acros Atovaquone, Thermo Scientific™

CAS: 95233-18-4 Molecular Formula: C22H19ClO3 Molecular Weight (g/mol): 366.84 MDL Number: 00889188 InChI Key: BSJMWHQBCZFXBR-UHFFFAOYSA-N IUPAC Name: 3-[4-(4-chlorophenyl)cyclohexyl]-4-hydroxy-1,2-dihydronaphthalene-1,2-dione SMILES: OC1=C(C2CCC(CC2)C2=CC=C(Cl)C=C2)C(=O)C(=O)C2=CC=CC=C12

CAS 95233-18-4
Molecular Weight (g/mol) 366.84
MDL Number 00889188
SMILES OC1=C(C2CCC(CC2)C2=CC=C(Cl)C=C2)C(=O)C(=O)C2=CC=CC=C12
IUPAC Name 3-[4-(4-chlorophenyl)cyclohexyl]-4-hydroxy-1,2-dihydronaphthalene-1,2-dione
InChI Key BSJMWHQBCZFXBR-UHFFFAOYSA-N
Molecular Formula C22H19ClO3
11

Thermo Scientific Acros Febantel, Thermo Scientific™

CAS: 58306-30-2 Molecular Formula: C20H22N4O6S Molecular Weight (g/mol): 446.48 MDL Number: 01738527 InChI Key: HMCCXLBXIJMERM-UHFFFAOYSA-N IUPAC Name: methyl N-{[(methoxycarbonyl)imino]({[2-(2-methoxyacetamido)-4-(phenylsulfanyl)phenyl]amino})methyl}carbamate SMILES: COCC(=O)NC1=CC(SC2=CC=CC=C2)=CC=C1NC(NC(=O)OC)=NC(=O)OC

CAS 58306-30-2
Molecular Weight (g/mol) 446.48
MDL Number 01738527
SMILES COCC(=O)NC1=CC(SC2=CC=CC=C2)=CC=C1NC(NC(=O)OC)=NC(=O)OC
IUPAC Name methyl N-{[(methoxycarbonyl)imino]({[2-(2-methoxyacetamido)-4-(phenylsulfanyl)phenyl]amino})methyl}carbamate
InChI Key HMCCXLBXIJMERM-UHFFFAOYSA-N
Molecular Formula C20H22N4O6S
12

Thermo Scientific Acros Guanethidine sulfate, Thermo Scientific™

CAS: 645-43-2 Molecular Formula: C10H24N4O4S Molecular Weight (g/mol): 296.39 MDL Number: MFCD00035403 InChI Key: YUFWAVFNITUSHI-UHFFFAOYSA-N IUPAC Name: N''-[2-(azocan-1-yl)ethyl]guanidine; sulfuric acid SMILES: OS(O)(=O)=O.NC(N)=NCCN1CCCCCCC1

CAS 645-43-2
Molecular Weight (g/mol) 296.39
MDL Number MFCD00035403
SMILES OS(O)(=O)=O.NC(N)=NCCN1CCCCCCC1
IUPAC Name N''-[2-(azocan-1-yl)ethyl]guanidine; sulfuric acid
InChI Key YUFWAVFNITUSHI-UHFFFAOYSA-N
Molecular Formula C10H24N4O4S
13

Thermo Scientific Acros Ketorolac tromethamine, Thermo Scientific™

CAS: 74103-07-4 Molecular Formula: C19H24N2O6 Molecular Weight (g/mol): 376.41 MDL Number: 00887595 InChI Key: BWHLPLXXIDYSNW-UHFFFAOYNA-N IUPAC Name: 2-amino-2-(hydroxymethyl)propane-1,3-diol; 5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid SMILES: NC(CO)(CO)CO.OC(=O)C1CCN2C1=CC=C2C(=O)C1=CC=CC=C1

CAS 74103-07-4
Molecular Weight (g/mol) 376.41
MDL Number 00887595
SMILES NC(CO)(CO)CO.OC(=O)C1CCN2C1=CC=C2C(=O)C1=CC=CC=C1
IUPAC Name 2-amino-2-(hydroxymethyl)propane-1,3-diol; 5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid
InChI Key BWHLPLXXIDYSNW-UHFFFAOYNA-N
Molecular Formula C19H24N2O6