Vitas-M small molecule compound
ethyl (5Z)-2-{[(4-methylphenyl)carbonyl]amino}-4-oxo-5-[4-(propan-2-yl)benzylidene]-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK022266
SMILES CCOC(=O)C1=C(S/C(=C\c2ccc(cc2)C(C)C)/C1=O)NC(=O)c1ccc(cc1)C
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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 C25H25NO4S MW 435.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO4S/c1-5-30-25(29)21-22(27)20(14-17-8-12-18(13-9-17)15(2)3)31-24(21)26-23(28)19-10-6-16(4)7-11-19/h6-15H,5H2,1-4H3,(H,26,28)/b20-14-InChIKey
KADZSSNGPVPJGN-ZHZULCJRSA-NSynonyms
CCOC(=O)C1=C(SC(=CC2=CC=C(C=C2)C(C)C)C1=O)NC(=O)C3=CC=C(C=C3)C
CCOC(=O)C1=C(SC(=Cc2ccc(cc2)C(C)C)C1=O)NC(=O)c1ccc(cc1)C
ETHYL(5Z)2(((4METHYLPHENYL)CARBONYL)AMINO)4OXO5(4(PROPAN2YL)BENZYLIDENE)45DIHYDROTHIOPHENE3CARBOXYLATE
ETHYL(5Z)2((4METHYLBENZOYL)AMINO)4OXO5((4PROPAN2YLPHENYL)METHYLIDENE)THIOPHENE3CARBOXYLATE
InChI=1SC25H25NO4Sc153025(29)2122(27)20(141781218(13917)15(2)3)3124(21)2623(28)1910616(4)71119h615H5H214H3(H2628)b2014
MFCD03711209
STK022266
ZINC000006227912
ZINC06227912
ZINC6227912
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