Vitas-M small molecule compound
(2E)-3-(2-chlorophenyl)-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)prop-2-enamide
Catalog ID
STK419172
SMILES CCC1CCc2c(C1)sc(c2C#N)NC(=O)/C=C/c1ccccc1Cl
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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 C20H19ClN2OS MW 370.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN2OS/c1-2-13-7-9-15-16(12-22)20(25-18(15)11-13)23-19(24)10-8-14-5-3-4-6-17(14)21/h3-6,8,10,13H,2,7,9,11H2,1H3,(H,23,24)/b10-8+InChIKey
VAFYBMBZYSRZGA-CSKARUKUSA-NSynonyms
(2E)3(2chlorophenyl)N(3cyano6ethyl4567tetrahydro1benzothiophen2yl)prop2enamide
(E)3(2chlorophenyl)N(3cyano6ethyl4567tetrahydro1benzothiophen2yl)prop2enamide
CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)C=CC3=CC=CC=C3Cl
CCC1CCc2c(C1)sc(c2C#N)NC(=O)C=Cc1ccccc1Cl
InChI=1SC20H19ClN2OSc1213791516(1222)20(2518(15)1113)2319(24)10814534617(14)21h3681013H27911H21H3(H2324)b108+
MFCD01355419
ZINC000000997350
ZINC000000997352
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