Vitas-M small molecule compound

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

Catalog ID
STK740772
SMILES CCOc1ccc(cc1)/C=c\1/s/c(=C(\C(=O)NC(c2ccccc2)C)/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 C29H25N3O3S MW 495.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O3S/c1-3-35-24-16-14-21(15-17-24)18-26-28(34)32(23-12-8-5-9-13-23)29(36-26)25(19-30)27(33)31-20(2)22-10-6-4-7-11-22/h4-18,20H,3H2,1-2H3,(H,31,33)/b26-18+,29-25-
InChIKey
XXOCMRUCIZRFLB-IMIYWQHTSA-N
Synonyms

(2Z)2cyano2((5E)5((4ethoxyphenyl)methylidene)4oxo3phenyl13thiazolidin2ylidene)N(1phenylethyl)acetamide
(2Z)2cyano2((5E)5(4ethoxybenzylidene)4oxo3phenyl13thiazolidin2ylidene)N(1phenylethyl)ethanamide
(E)2cyano2((E)5(4ethoxybenzylidene)4oxo3phenylthiazolidin2ylidene)N(1phenylethyl)acetamide
2CYANO2(5((4ETHOXYPHENYL)METHYLENE)4OXO3PHENYL(13THIAZOLIDIN2YLIDENE))N(PHENYLETHYL)ACETAMIDE
CCOC1=CC=C(C=C1)C=C2C(=O)N(C(=C(C#N)C(=O)NC(C)C3=CC=CC=C3)S2)C4=CC=CC=C4
CCOc1ccc(cc1)C=c1sc(=C(C(=O)NC(c2ccccc2)C)C#N)n(c1=O)c1ccccc1
InChI=1SC29H25N3O3Sc133524161421(151724)182628(34)32(23128591323)29(3626)25(1930)27(33)3120(2)22106471122h41820H3H212H3(H3133)b2618+2925
MFCD06438696
ZINC000008951699
ZINC000015401582

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Available files

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