Vitas-M small molecule compound
(2E)-4-{[3-(benzylcarbamoyl)-4-ethyl-5-methylthiophen-2-yl]amino}-4-oxobut-2-enoic acid
Catalog ID
STK473989
SMILES CCc1c(C)sc(c1C(=O)NCc1ccccc1)NC(=O)/C=C/C(=O)O
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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 C19H20N2O4S MW 372.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O4S/c1-3-14-12(2)26-19(21-15(22)9-10-16(23)24)17(14)18(25)20-11-13-7-5-4-6-8-13/h4-10H,3,11H2,1-2H3,(H,20,25)(H,21,22)(H,23,24)/b10-9+InChIKey
GHEICURXZNDPLI-MDZDMXLPSA-NSynonyms
(2E)3(N(4ETHYL5METHYL3(NBENZYLCARBAMOYL)(2THIENYL))CARBAMOYL)PROP2ENOICACID
(2E)4((3(benzylcarbamoyl)4ethyl5methylthiophen2yl)amino)4oxobut2enoicacid
(E)4((3(benzylcarbamoyl)4ethyl5methylthiophen2yl)amino)4oxobut2enoicacid
CCC1=C(SC(=C1C(=O)NCC2=CC=CC=C2)NC(=O)C=CC(=O)O)C
CCc1c(C)sc(c1C(=O)NCc1ccccc1)NC(=O)C=CC(=O)O
InChI=1SC19H20N2O4Sc131412(2)2619(2115(22)91016(23)24)17(14)18(25)2011137546813h410H311H212H3(H2025)(H2122)(H2324)b109+
MFCD06026333
ZINC000017076250
ZINC17076250
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