Vitas-M small molecule compound
ethyl 2-{[(2E)-3-(2-chlorophenyl)prop-2-enoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK417127
SMILES CCOC(=O)c1c(NC(=O)/C=C/c2ccccc2Cl)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 C20H20ClNO3S MW 389.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClNO3S/c1-2-25-20(24)18-14-8-4-6-10-16(14)26-19(18)22-17(23)12-11-13-7-3-5-9-15(13)21/h3,5,7,9,11-12H,2,4,6,8,10H2,1H3,(H,22,23)/b12-11+InChIKey
FPDXSLWXPOYSJI-VAWYXSNFSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C=CC3=CC=CC=C3Cl
CCOC(=O)c1c(NC(=O)C=Cc2ccccc2Cl)sc2c1CCCC2
ethyl2(((2E)3(2chlorophenyl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2(((E)3(2chlorophenyl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC20H20ClNO3Sc122520(24)18148461016(14)2619(18)2217(23)121113735915(13)21h35791112H246810H21H3(H2223)b1211+
MFCD00706711
ZINC000001903807
ZINC01903807
ZINC1903807
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