Vitas-M small molecule compound
ethyl 4-(4-chlorophenyl)-2-({(2E)-2-cyano-3-[4-(diethylamino)phenyl]prop-2-enoyl}amino)thiophene-3-carboxylate
Catalog ID
STL020986
SMILES CCOC(=O)c1c(scc1c1ccc(cc1)Cl)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 C27H26ClN3O3S MW 508.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClN3O3S/c1-4-31(5-2)22-13-7-18(8-14-22)15-20(16-29)25(32)30-26-24(27(33)34-6-3)23(17-35-26)19-9-11-21(28)12-10-19/h7-15,17H,4-6H2,1-3H3,(H,30,32)/b20-15+InChIKey
VWGXIWRYGKQVIA-HMMYKYKNSA-NSynonyms
380455-54-9(E)ethyl4(4chlorophenyl)2(2cyano3(4(diethylamino)phenyl)acrylamido)thiophene3carboxylate
380455549
CCN(CC)C1=CC=C(C=C1)C=C(C#N)C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)Cl)C(=O)OCC
CCOC(=O)c1c(scc1c1ccc(cc1)Cl)NC(=O)C(=Cc1ccc(cc1)N(CC)CC)C#N
ETHYL2((2E)3(4(DIETHYLAMINO)PHENYL)2CYANOPROP2ENOYLAMINO)4(4CHLOROPHENYL)THIOPHENE3CARBOXYLATE
ethyl4(4chlorophenyl)2(((2E)2cyano3(4(diethylamino)phenyl)prop2enoyl)amino)thiophene3carboxylate
ETHYL4(4CHLOROPHENYL)2(((E)2CYANO3(4(DIETHYLAMINO)PHENYL)PROP2ENOYL)AMINO)THIOPHENE3CARBOXYLATE
InChI=1SC27H26ClN3O3Sc1431(52)2213718(81422)1520(1629)25(32)302624(27(33)3463)23(173526)1991121(28)121019h71517H46H213H3(H3032)b2015+
MFCD02957261
ZINC000002349421
ZINC02349421
ZINC2349421
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.