Vitas-M small molecule compound
(5Z)-5-{[3-(4-methoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK799010
SMILES COc1ccc(cc1C)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CCc1ccccc1)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 C29H25N3O2S2 MW 511.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O2S2/c1-20-17-22(13-14-25(20)34-2)27-23(19-32(30-27)24-11-7-4-8-12-24)18-26-28(33)31(29(35)36-26)16-15-21-9-5-3-6-10-21/h3-14,17-19H,15-16H2,1-2H3/b26-18-InChIKey
ZCKFEJWOPYHWTN-ITYLOYPMSA-NSynonyms
(5Z)5((3(4methoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylidene)3(2phenylethyl)2thioxo13thiazolidin4one
(5Z)5((3(4methoxy3methylphenyl)1phenylpyrazol4yl)methylidene)3(2phenylethyl)2sulfanylidene13thiazolidin4one
(5Z)5((3(4METHOXY3METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3PHENETHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
CC1=C(C=CC(=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)C5=CC=CC=C5)OC
COc1ccc(cc1C)c1nn(cc1C=C1SC(=S)N(C1=O)CCc1ccccc1)c1ccccc1
InChI=1SC29H25N3O2S2c1201722(131425(20)342)2723(1932(3027)24117481224)182628(33)31(29(35)3626)16152195361021h3141719H1516H212H3b2618
MFCD03462196
ZINC000016700663
ZINC16700663
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