Vitas-M small molecule compound
4-({(2E)-3-(3,4-diethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}amino)benzoic acid
Catalog ID
STK554087
SMILES CCOc1cc(ccc1OCC)/C=C(\C(=O)Nc1ccc(cc1)C(=O)O)/NC(=O)c1ccccc1
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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 C27H26N2O6 MW 474.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O6/c1-3-34-23-15-10-18(17-24(23)35-4-2)16-22(29-25(30)19-8-6-5-7-9-19)26(31)28-21-13-11-20(12-14-21)27(32)33/h5-17H,3-4H2,1-2H3,(H,28,31)(H,29,30)(H,32,33)/b22-16+InChIKey
GNRZIJQRPJLHSZ-CJLVFECKSA-NSynonyms
840470-88-4(E)4(2benzamido3(34diethoxyphenyl)acrylamido)benzoicacid
4(((2E)3(34diethoxyphenyl)2((phenylcarbonyl)amino)prop2enoyl)amino)benzoicacid
4(((E)2BENZAMIDO3(34DIETHOXYPHENYL)PROP2ENOYL)AMINO)BENZOICACID
840470884
CCOC1=C(C=C(C=C1)C=C(C(=O)NC2=CC=C(C=C2)C(=O)O)NC(=O)C3=CC=CC=C3)OCC
CCOc1cc(ccc1OCC)C=C(C(=O)Nc1ccc(cc1)C(=O)O)NC(=O)c1ccccc1
InChI=1SC27H26N2O6c133423151018(1724(23)3542)1622(2925(30)198657919)26(31)2821131120(121421)27(32)33h517H34H212H3(H2831)(H2930)(H3233)b2216+
MFCD03827626
ZINC000009462141
ZINC9462141
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