Vitas-M small molecule compound

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

Catalog ID
STL021545
SMILES N#C/C(=C\1/SC(C(=O)N1c1ccccc1)Cc1cccc(c1)Cl)/C(=O)Nc1cc(C)ccc1C

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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 C27H22ClN3O2S MW 488.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22ClN3O2S/c1-17-11-12-18(2)23(13-17)30-25(32)22(16-29)27-31(21-9-4-3-5-10-21)26(33)24(34-27)15-19-7-6-8-20(28)14-19/h3-14,24H,15H2,1-2H3,(H,30,32)/b27-22-
InChIKey
DBMIJHYBVLQVQD-QYQHSDTDSA-N
Synonyms

(2Z)2(5((3chlorophenyl)methyl)4oxo3phenyl13thiazolidin2ylidene)2cyanoN(25dimethylphenyl)acetamide
(2Z)2(5(3chlorobenzyl)4oxo3phenyl13thiazolidin2ylidene)2cyanoN(25dimethylphenyl)ethanamide
CC1=CC(=C(C=C1)C)NC(=O)C(=C2N(C(=O)C(S2)CC3=CC(=CC=C3)Cl)C4=CC=CC=C4)C#N
InChI=1SC27H22ClN3O2Sc117111218(2)23(1317)3025(32)22(1629)2731(2194351021)26(33)24(3427)151976820(28)1419h31424H15H212H3(H3032)b2722
MFCD06438315
N#CC(=C1SC(C(=O)N1c1ccccc1)Cc1cccc(c1)Cl)C(=O)Nc1cc(C)ccc1C
N(25DIMETHYLPHENYL)2(5((3CHLOROPHENYL)METHYL)4OXO3PHENYL(13THIAZOLIDIN2YLIDENE))2CYANOACETAMIDE
ZINC000012273770
ZINC000012273771

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Available files

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