Vitas-M small molecule compound
ethyl 4-methyl-2-{[(2E)-3-(4-methylphenyl)prop-2-enoyl]amino}-5-(phenylcarbamoyl)thiophene-3-carboxylate
Catalog ID
STK088177
SMILES CCOC(=O)c1c(NC(=O)/C=C/c2ccc(cc2)C)sc(c1C)C(=O)Nc1ccccc1
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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 C25H24N2O4S MW 448.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O4S/c1-4-31-25(30)21-17(3)22(23(29)26-19-8-6-5-7-9-19)32-24(21)27-20(28)15-14-18-12-10-16(2)11-13-18/h5-15H,4H2,1-3H3,(H,26,29)(H,27,28)/b15-14+InChIKey
SRIIAPDOBHCPLD-CCEZHUSRSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2)NC(=O)C=CC3=CC=C(C=C3)C
CCOC(=O)c1c(NC(=O)C=Cc2ccc(cc2)C)sc(c1C)C(=O)Nc1ccccc1
ETHYL2((2E)3(4METHYLPHENYL)PROP2ENOYLAMINO)4METHYL5(NPHENYLCARBAMOYL)THIOPHENE3CARBOXYLATE
ETHYL4METHYL2(((2E)3(4METHYLPHENYL)PROP2ENOYL)AMINO)5(PHENYLCARBAMOYL)THIOPHENE3CARBOXYLATE
ETHYL4METHYL2(((E)3(4METHYLPHENYL)PROP2ENOYL)AMINO)5(PHENYLCARBAMOYL)THIOPHENE3CARBOXYLATE
InChI=1SC25H24N2O4Sc143125(30)2117(3)22(23(29)26198657919)3224(21)2720(28)151418121016(2)111318h515H4H213H3(H2629)(H2728)b1514+
MFCD01458793
STK088177
ZINC000002707084
ZINC02707084
ZINC2707084
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