Vitas-M small molecule compound
ethyl 4-(4-chlorophenyl)-2-{[(2E)-2-cyano-3-(2-propoxyphenyl)prop-2-enoyl]amino}thiophene-3-carboxylate
Catalog ID
STK949797
SMILES CCCOc1ccccc1/C=C(/C(=O)Nc1scc(c1C(=O)OCC)c1ccc(cc1)Cl)\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 C26H23ClN2O4S MW 495.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClN2O4S/c1-3-13-33-22-8-6-5-7-18(22)14-19(15-28)24(30)29-25-23(26(31)32-4-2)21(16-34-25)17-9-11-20(27)12-10-17/h5-12,14,16H,3-4,13H2,1-2H3,(H,29,30)/b19-14+InChIKey
QEDILIGGWHFXEY-XMHGGMMESA-NSynonyms
CCCOC1=CC=CC=C1C=C(C#N)C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)Cl)C(=O)OCC
CCCOc1ccccc1C=C(C(=O)Nc1scc(c1C(=O)OCC)c1ccc(cc1)Cl)C#N
ETHYL2((2E)2CYANO3(2PROPOXYPHENYL)PROP2ENOYLAMINO)4(4CHLOROPHENYL)THIOPHENE3CARBOXYLATE
ethyl4(4chlorophenyl)2(((2E)2cyano3(2propoxyphenyl)prop2enoyl)amino)thiophene3carboxylate
ETHYL4(4CHLOROPHENYL)2(((E)2CYANO3(2PROPOXYPHENYL)PROP2ENOYL)AMINO)THIOPHENE3CARBOXYLATE
InChI=1SC26H23ClN2O4Sc13133322865718(22)1419(1528)24(30)292523(26(31)3242)21(163425)1791120(27)121017h5121416H3413H212H3(H2930)b1914+
MFCD01959037
ZINC000001932485
ZINC01932485
ZINC1932485
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