Vitas-M small molecule compound
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5,7-dimethyl-4-oxo-4H-chromene-2-carboxamide
Catalog ID
STK853554
SMILES N#Cc1c(NC(=O)c2cc(=O)c3c(o2)cc(cc3C)C)sc2c1CCCC2
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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 C21H18N2O3S MW 378.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O3S/c1-11-7-12(2)19-15(24)9-17(26-16(19)8-11)20(25)23-21-14(10-22)13-5-3-4-6-18(13)27-21/h7-9H,3-6H2,1-2H3,(H,23,25)InChIKey
LXDWXBBPUHWMNE-UHFFFAOYSA-NSynonyms
879580-22-0879580220
CC1=CC(=C2C(=C1)OC(=CC2=O)C(=O)NC3=C(C4=C(S3)CCCC4)C#N)C
InChI=1SC21H18N2O3Sc111712(2)1915(24)917(2616(19)811)20(25)232114(1022)13534618(13)2721h79H36H212H3(H2325)
MFCD06787110
N(3cyano4567tetrahydro1benzothiophen2yl)57dimethyl4oxo4Hchromene2carboxamide
N(3cyano4567tetrahydro1benzothiophen2yl)57dimethyl4oxochromene2carboxamide
N(3cyano4567tetrahydrobenzo(b)thiophen2yl)57dimethyl4oxo4Hchromene2carboxamide
ZINC000006660494
ZINC06660494
ZINC6660494
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