Vitas-M small molecule compound

ethyl 2-{[(2E)-2-cyano-3-phenylprop-2-enoyl]amino}-4-(4-methylphenyl)thiophene-3-carboxylate

Catalog ID
STK740154
SMILES CCOC(=O)c1c(scc1c1ccc(cc1)C)NC(=O)/C(=C/c1ccccc1)/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 C24H20N2O3S MW 416.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N2O3S/c1-3-29-24(28)21-20(18-11-9-16(2)10-12-18)15-30-23(21)26-22(27)19(14-25)13-17-7-5-4-6-8-17/h4-13,15H,3H2,1-2H3,(H,26,27)/b19-13+
InChIKey
CWTWPWSIWXTBKW-CPNJWEJPSA-N
Synonyms
372496-40-7
(E)ethyl2(2cyano3phenylacrylamido)4(ptolyl)thiophene3carboxylate
372496407
CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)C(=CC3=CC=CC=C3)C#N
CCOC(=O)c1c(scc1c1ccc(cc1)C)NC(=O)C(=Cc1ccccc1)C#N
ethyl2(((2E)2cyano3phenylprop2enoyl)amino)4(4methylphenyl)thiophene3carboxylate
ETHYL2(((E)2CYANO3PHENYLPROP2ENOYL)AMINO)4(4METHYLPHENYL)THIOPHENE3CARBOXYLATE
ETHYL2((2E)2CYANO3PHENYLPROP2ENOYLAMINO)4(4METHYLPHENYL)THIOPHENE3CARBOXYLATE
InChI=1SC24H20N2O3Sc132924(28)2120(1811916(2)101218)153023(21)2622(27)19(1425)13177546817h41315H3H212H3(H2627)b1913+
MFCD01943087
ZINC000002276931
ZINC02276931
ZINC2276931

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.