Vitas-M small molecule compound
7-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-oxo-3,4-dihydro-1H-isochromene-3-carboxamide
Catalog ID
STK249058
SMILES N#Cc1c(NC(=O)C2OC(=O)c3c(C2)ccc(c3)Cl)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 C19H15ClN2O3S MW 386.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15ClN2O3S/c20-11-6-5-10-7-15(25-19(24)13(10)8-11)17(23)22-18-14(9-21)12-3-1-2-4-16(12)26-18/h5-6,8,15H,1-4,7H2,(H,22,23)InChIKey
NQBASQHPDFFCGU-UHFFFAOYSA-NSynonyms
892710-20-27chloroN(3cyano4567tetrahydro1benzothiophen2yl)1oxo34dihydro1Hisochromene3carboxamide
7chloroN(3cyano4567tetrahydro1benzothiophen2yl)1oxo34dihydroisochromene3carboxamide
7chloroN(3cyano4567tetrahydrobenzo(b)thiophen2yl)1oxoisochroman3carboxamide
892710202
C1CCC2=C(C1)C(=C(S2)NC(=O)C3CC4=C(C=C(C=C4)Cl)C(=O)O3)C#N
InChI=1SC19H15ClN2O3Sc20116510715(2519(24)13(10)811)17(23)221814(921)12312416(12)2618h56815H147H2(H2223)
MFCD08568735
ZINC000008020877
ZINC000008020892
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