Vitas-M small molecule compound
(2E)-2-{[(4-chlorophenyl)carbonyl]amino}-3-(3,4-diethoxyphenyl)prop-2-enoic acid
Catalog ID
STK557303
SMILES CCOc1cc(ccc1OCC)/C=C(\C(=O)O)/NC(=O)c1ccc(cc1)Cl
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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 C20H20ClNO5 MW 389.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClNO5/c1-3-26-17-10-5-13(12-18(17)27-4-2)11-16(20(24)25)22-19(23)14-6-8-15(21)9-7-14/h5-12H,3-4H2,1-2H3,(H,22,23)(H,24,25)/b16-11+InChIKey
WDKIIIGXBOOQCB-LFIBNONCSA-NSynonyms
578751-27-6(2E)2(((4chlorophenyl)carbonyl)amino)3(34diethoxyphenyl)prop2enoicacid
(E)2((4CHLOROBENZOYL)AMINO)3(34DIETHOXYPHENYL)PROP2ENOICACID
(E)2(4chlorobenzamido)3(34diethoxyphenyl)acrylicacid
(E)2(4CHLOROBENZOYLAMINO)3(34DIETHOXYPHENYL)ACRYLICACID
578751276
CCOC1=C(C=C(C=C1)C=C(C(=O)O)NC(=O)C2=CC=C(C=C2)Cl)OCC
CCOc1cc(ccc1OCC)C=C(C(=O)O)NC(=O)c1ccc(cc1)Cl
InChI=1SC20H20ClNO5c13261710513(1218(17)2742)1116(20(24)25)2219(23)146815(21)9714h512H34H212H3(H2223)(H2425)b1611+
MFCD04024322
ZINC000005072437
ZINC5072437
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