Vitas-M small molecule compound
2-(benzylsulfanyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Catalog ID
STK081233
SMILES N#Cc1cc2C(=O)CC(Cc2nc1SCc1ccccc1)(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 C19H18N2OS MW 322.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2OS/c1-19(2)9-16-15(17(22)10-19)8-14(11-20)18(21-16)23-12-13-6-4-3-5-7-13/h3-8H,9-10,12H2,1-2H3InChIKey
WCUNNKNYJUBPJN-UHFFFAOYSA-NSynonyms
332177-08-92(benzylsulfanyl)77dimethyl5oxo5678tetrahydroquinoline3carbonitrile
2(benzylthio)77dimethyl5oxo5678tetrahydroquinoline3carbonitrile
2BENZYLSULFANYL77DIMETHYL5OXO68DIHYDROQUINOLINE3CARBONITRILE
332177089
77DIMETHYL5OXO2(PHENYLMETHYLTHIO)678TRIHYDROQUINOLINE3CARBONITRILE
CC1(CC2=C(C=C(C(=N2)SCC3=CC=CC=C3)C#N)C(=O)C1)C
InChI=1SC19H18N2OSc119(2)91615(17(22)1019)814(1120)18(2116)2312136435713h38H91012H212H3
MFCD02045992
N#Cc1cc2C(=O)CC(Cc2nc1SCc1ccccc1)(C)C
STK081233
ZINC000000121928
ZINC00121928
ZINC121928
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