Vitas-M small molecule compound

(2E)-2-cyano-N-(2,3-dimethylphenyl)-2-[5-(4-methylbenzyl)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]ethanamide

Catalog ID
STL337721
SMILES N#C/C(=C/1\SC(C(=O)N1c1ccccc1)Cc1ccc(cc1)C)/C(=O)Nc1cccc(c1C)C

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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 C28H25N3O2S MW 467.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O2S/c1-18-12-14-21(15-13-18)16-25-27(33)31(22-9-5-4-6-10-22)28(34-25)23(17-29)26(32)30-24-11-7-8-19(2)20(24)3/h4-15,25H,16H2,1-3H3,(H,30,32)/b28-23+
InChIKey
NIKPCJDOOPWJIM-WEMUOSSPSA-N
Synonyms
799802-77-0
(2E)2cyanoN(23dimethylphenyl)2(5((4methylphenyl)methyl)4oxo3phenyl13thiazolidin2ylidene)acetamide
(2E)2cyanoN(23dimethylphenyl)2(5(4methylbenzyl)4oxo3phenyl13thiazolidin2ylidene)ethanamide
(E)2cyanoN(23dimethylphenyl)2(5(4methylbenzyl)4oxo3phenylthiazolidin2ylidene)acetamide
799802770
CC1=CC=C(C=C1)CC2C(=O)N(C(=C(C#N)C(=O)NC3=CC=CC(=C3C)C)S2)C4=CC=CC=C4
InChI=1SC28H25N3O2Sc118121421(151318)162527(33)31(2295461022)28(3425)23(1729)26(32)3024117819(2)20(24)3h41525H16H213H3(H3032)b2823+
MFCD03678975
N#CC(=C1SC(C(=O)N1c1ccccc1)Cc1ccc(cc1)C)C(=O)Nc1cccc(c1C)C
ZINC000002225014
ZINC000002225019

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Available files

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