Vitas-M small molecule compound

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

Catalog ID
STL022253
SMILES N#C/C(=C\1/SC(C(=O)N1c1ccc(cc1)C)Cc1cccc(c1)C)/C(=O)Nc1ccc(cc1)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/c1-18-7-11-22(12-8-18)30-26(32)24(17-29)28-31(23-13-9-19(2)10-14-23)27(33)25(34-28)16-21-6-4-5-20(3)15-21/h4-15,25H,16H2,1-3H3,(H,30,32)/b28-24-
InChIKey
NQBPTIVULNHHNO-COOPMVRXSA-N
Synonyms

(2Z)2cyano2(5(3methylbenzyl)3(4methylphenyl)4oxo13thiazolidin2ylidene)N(4methylphenyl)ethanamide
(2Z)2CYANON(4METHYLPHENYL)2(3(4METHYLPHENYL)5((3METHYLPHENYL)METHYL)4OXO13THIAZOLIDIN2YLIDENE)ACETAMIDE
2CYANON(4METHYLPHENYL)2(3(4METHYLPHENYL)5((3METHYLPHENYL)METHYL)4OXO(13THIAZOLIDIN2YLIDENE))ACETAMIDE
CC1=CC=C(C=C1)NC(=O)C(=C2N(C(=O)C(S2)CC3=CC=CC(=C3)C)C4=CC=C(C=C4)C)C#N
InChI=1SC28H25N3O2Sc11871122(12818)3026(32)24(1729)2831(2313919(2)101423)27(33)25(3428)162164520(3)1521h41525H16H213H3(H3032)b2824
MFCD06640593
N#CC(=C1SC(C(=O)N1c1ccc(cc1)C)Cc1cccc(c1)C)C(=O)Nc1ccc(cc1)C
ZINC000000935037
ZINC000000935039

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Available files

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