Vitas-M small molecule compound
ethyl 4-(4-bromophenyl)-2-({(2E)-2-cyano-3-[4-(propan-2-yl)phenyl]prop-2-enoyl}amino)thiophene-3-carboxylate
Catalog ID
STK524408
SMILES CCOC(=O)c1c(scc1c1ccc(cc1)Br)NC(=O)/C(=C/c1ccc(cc1)C(C)C)/C#N
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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 C26H23BrN2O3S MW 523.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23BrN2O3S/c1-4-32-26(31)23-22(19-9-11-21(27)12-10-19)15-33-25(23)29-24(30)20(14-28)13-17-5-7-18(8-6-17)16(2)3/h5-13,15-16H,4H2,1-3H3,(H,29,30)/b20-13+InChIKey
NPUHFBXGQDRZKS-DEDYPNTBSA-NSynonyms
372499-82-6(E)ethyl4(4bromophenyl)2(2cyano3(4isopropylphenyl)acrylamido)thiophene3carboxylate
372499826
CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C(=CC3=CC=C(C=C3)C(C)C)C#N
CCOC(=O)c1c(scc1c1ccc(cc1)Br)NC(=O)C(=Cc1ccc(cc1)C(C)C)C#N
ethyl4(4bromophenyl)2(((2E)2cyano3(4(propan2yl)phenyl)prop2enoyl)amino)thiophene3carboxylate
ETHYL4(4BROMOPHENYL)2(((E)2CYANO3(4PROPAN2YLPHENYL)PROP2ENOYL)AMINO)THIOPHENE3CARBOXYLATE
InChI=1SC26H23BrN2O3Sc143226(31)2322(1991121(27)121019)153325(23)2924(30)20(1428)13175718(8617)16(2)3h5131516H4H213H3(H2930)b2013+
MFCD01943439
ZINC000002277155
ZINC2277155
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