Vitas-M small molecule compound

(2Z)-N-(4-chlorophenyl)-2-cyano-2-[(5E)-5-(4-ethoxybenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]ethanamide

Catalog ID
STL257821
SMILES CCOc1ccc(cc1)/C=c\1/s/c(=C(\C(=O)Nc2ccc(cc2)Cl)/C#N)/n(c1=O)c1ccccc1

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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 C27H20ClN3O3S MW 501.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20ClN3O3S/c1-2-34-22-14-8-18(9-15-22)16-24-26(33)31(21-6-4-3-5-7-21)27(35-24)23(17-29)25(32)30-20-12-10-19(28)11-13-20/h3-16H,2H2,1H3,(H,30,32)/b24-16+,27-23-
InChIKey
FJPBFODXOPYTDL-QCKPYFJXSA-N
Synonyms

(2Z)N(4chlorophenyl)2cyano2((5E)5((4ethoxyphenyl)methylidene)4oxo3phenyl13thiazolidin2ylidene)acetamide
(2Z)N(4chlorophenyl)2cyano2((5E)5(4ethoxybenzylidene)4oxo3phenyl13thiazolidin2ylidene)ethanamide
(E)N(4chlorophenyl)2cyano2((E)5(4ethoxybenzylidene)4oxo3phenylthiazolidin2ylidene)acetamide
CCOC1=CC=C(C=C1)C=C2C(=O)N(C(=C(C#N)C(=O)NC3=CC=C(C=C3)Cl)S2)C4=CC=CC=C4
CCOc1ccc(cc1)C=c1sc(=C(C(=O)Nc2ccc(cc2)Cl)C#N)n(c1=O)c1ccccc1
InChI=1SC27H20ClN3O3Sc12342214818(91522)162426(33)31(216435721)27(3524)23(1729)25(32)3020121019(28)111320h316H2H21H3(H3032)b2416+2723
MFCD06438462
N(4CHLOROPHENYL)2CYANO2(5((4ETHOXYPHENYL)METHYLENE)4OXO3PHENYL(13THIAZOLIDIN2YLIDENE))ACETAMIDE
ZINC000012273831
ZINC12273831

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Available files

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