Vitas-M small molecule compound

(2Z)-2-cyano-2-[5-(3,4-dimethylbenzyl)-3-(4-methylphenyl)-4-oxo-1,3-thiazolidin-2-ylidene]-N-methylethanamide

Catalog ID
STK740598
SMILES CNC(=O)/C(=C/1\SC(C(=O)N1c1ccc(cc1)C)Cc1ccc(c(c1)C)C)/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 C23H23N3O2S MW 405.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O2S/c1-14-5-9-18(10-6-14)26-22(28)20(12-17-8-7-15(2)16(3)11-17)29-23(26)19(13-24)21(27)25-4/h5-11,20H,12H2,1-4H3,(H,25,27)/b23-19-
InChIKey
CYBSKIUZKKAIHS-NMWGTECJSA-N
Synonyms

(2Z)2CYANO2(5((34DIMETHYLPHENYL)METHYL)3(4METHYLPHENYL)4OXO13THIAZOLIDIN2YLIDENE)NMETHYLACETAMIDE
(2Z)2cyano2(5(34dimethylbenzyl)3(4methylphenyl)4oxo13thiazolidin2ylidene)Nmethylethanamide
(E)2cyano2(5(34dimethylbenzyl)4oxo3(ptolyl)thiazolidin2ylidene)Nmethylacetamide
2(5((34DIMETHYLPHENYL)METHYL)3(4METHYLPHENYL)4OXO(13THIAZOLIDIN2YLIDENE))2CYANONMETHYLACETAMIDE
2CYANO2(5(34DIMETHYLBENZYL)3(4METHYLPHENYL)4OXO13THIAZOLIDIN2YLIDENE)NMETHYLACETAMIDE
CC1=CC=C(C=C1)N2C(=O)C(SC2=C(C#N)C(=O)NC)CC3=CC(=C(C=C3)C)C
CNC(=O)C(=C1SC(C(=O)N1c1ccc(cc1)C)Cc1ccc(c(c1)C)C)C#N
InChI=1SC23H23N3O2Sc1145918(10614)2622(28)20(12178715(2)16(3)1117)2923(26)19(1324)21(27)254h51120H12H214H3(H2527)b2319
MFCD06438399
ZINC000004539949
ZINC000004539951

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Available files

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