Vitas-M small molecule compound
7,7-dimethyl-5-oxo-2-[(3-oxo-3-phenylpropyl)sulfanyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Catalog ID
STK051152
SMILES N#Cc1cc2C(=O)CC(Cc2nc1SCCC(=O)c1ccccc1)(C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H20N2O2S MW 364.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O2S/c1-21(2)11-17-16(19(25)12-21)10-15(13-22)20(23-17)26-9-8-18(24)14-6-4-3-5-7-14/h3-7,10H,8-9,11-12H2,1-2H3InChIKey
ULFMNVWHICRADF-UHFFFAOYSA-NSynonyms
77dimethyl5oxo2((3oxo3phenylpropyl)sulfanyl)5678tetrahydroquinoline3carbonitrile
77DIMETHYL5OXO2(3OXO3PHENYLPROPYL)SULFANYL68DIHYDROQUINOLINE3CARBONITRILE
CC1(CC2=C(C=C(C(=N2)SCCC(=O)C3=CC=CC=C3)C#N)C(=O)C1)C
InChI=1SC21H20N2O2Sc121(2)111716(19(25)1221)1015(1322)20(2317)269818(24)146435714h3710H891112H212H3
MFCD08051106
N#Cc1cc2C(=O)CC(Cc2nc1SCCC(=O)c1ccccc1)(C)C
STK051152
ZINC000013943632
ZINC13943632
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