Vitas-M small molecule compound
ethyl 2-({(2E)-2-cyano-3-[4-(diethylamino)phenyl]prop-2-enoyl}amino)-4-phenylthiophene-3-carboxylate
Catalog ID
STK952753
SMILES CCOC(=O)c1c(scc1c1ccccc1)NC(=O)/C(=C/c1ccc(cc1)N(CC)CC)/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 C27H27N3O3S MW 473.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O3S/c1-4-30(5-2)22-14-12-19(13-15-22)16-21(17-28)25(31)29-26-24(27(32)33-6-3)23(18-34-26)20-10-8-7-9-11-20/h7-16,18H,4-6H2,1-3H3,(H,29,31)/b21-16+InChIKey
ZUEJCDDBHSNXDR-LTGZKZEYSA-NSynonyms
380455-67-4(E)ethyl2(2cyano3(4(diethylamino)phenyl)acrylamido)4phenylthiophene3carboxylate
380455674
CCN(CC)C1=CC=C(C=C1)C=C(C#N)C(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OCC
CCOC(=O)c1c(scc1c1ccccc1)NC(=O)C(=Cc1ccc(cc1)N(CC)CC)C#N
ethyl2(((2E)2cyano3(4(diethylamino)phenyl)prop2enoyl)amino)4phenylthiophene3carboxylate
ETHYL2(((E)2CYANO3(4(DIETHYLAMINO)PHENYL)PROP2ENOYL)AMINO)4PHENYLTHIOPHENE3CARBOXYLATE
ETHYL2((2E)3(4(DIETHYLAMINO)PHENYL)2CYANOPROP2ENOYLAMINO)4PHENYLTHIOPHENE3CARBOXYLATE
InChI=1SC27H27N3O3Sc1430(52)22141219(131522)1621(1728)25(31)292624(27(32)3363)23(183426)20108791120h71618H46H213H3(H2931)b2116+
MFCD02957258
ZINC000002304601
ZINC02304601
ZINC2304601
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.