Vitas-M small molecule compound
ethyl 4-(4-chlorophenyl)-2-{[(2E)-2-cyano-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]amino}thiophene-3-carboxylate
Catalog ID
STK952758
SMILES CCOC(=O)c1c(scc1c1ccc(cc1)Cl)NC(=O)/C(=C/c1ccc(c(c1)OC)O)/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 C24H19ClN2O5S MW 482.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19ClN2O5S/c1-3-32-24(30)21-18(15-5-7-17(25)8-6-15)13-33-23(21)27-22(29)16(12-26)10-14-4-9-19(28)20(11-14)31-2/h4-11,13,28H,3H2,1-2H3,(H,27,29)/b16-10+InChIKey
PQVVRQBXHYYRIB-MHWRWJLKSA-NSynonyms
380457-75-0(E)ethyl4(4chlorophenyl)2(2cyano3(4hydroxy3methoxyphenyl)acrylamido)thiophene3carboxylate
380457750
CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)C(=CC3=CC(=C(C=C3)O)OC)C#N
CCOC(=O)c1c(scc1c1ccc(cc1)Cl)NC(=O)C(=Cc1ccc(c(c1)OC)O)C#N
ETHYL2((2E)2CYANO3(4HYDROXY3METHOXYPHENYL)PROP2ENOYLAMINO)4(4CHLOROPHENYL)THIOPHENE3CARBOXYLATE
ethyl4(4chlorophenyl)2(((2E)2cyano3(4hydroxy3methoxyphenyl)prop2enoyl)amino)thiophene3carboxylate
ETHYL4(4CHLOROPHENYL)2(((E)2CYANO3(4HYDROXY3METHOXYPHENYL)PROP2ENOYL)AMINO)THIOPHENE3CARBOXYLATE
InChI=1SC24H19ClN2O5Sc133224(30)2118(155717(25)8615)133323(21)2722(29)16(1226)10144919(28)20(1114)312h4111328H3H212H3(H2729)b1610+
MFCD02957170
ZINC000001453720
ZINC01453720
ZINC1453720
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.