Vitas-M small molecule compound
(5Z)-5-{[3-(4-methoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-pentyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK799005
SMILES CCCCCN1C(=S)S/C(=C\c2cn(nc2c2ccc(c(c2)C)OC)c2ccccc2)/C1=O
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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 C26H27N3O2S2 MW 477.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O2S2/c1-4-5-9-14-28-25(30)23(33-26(28)32)16-20-17-29(21-10-7-6-8-11-21)27-24(20)19-12-13-22(31-3)18(2)15-19/h6-8,10-13,15-17H,4-5,9,14H2,1-3H3/b23-16-InChIKey
CQVOIGXGBSPXSA-KQWNVCNZSA-NSynonyms
(5Z)5((3(4methoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylidene)3pentyl2thioxo13thiazolidin4one
(5Z)5((3(4methoxy3methylphenyl)1phenylpyrazol4yl)methylidene)3pentyl2sulfanylidene13thiazolidin4one
CCCCCN1C(=O)C(=CC2=CN(N=C2C3=CC(=C(C=C3)OC)C)C4=CC=CC=C4)SC1=S
CCCCCN1C(=S)SC(=Cc2cn(nc2c2ccc(c(c2)C)OC)c2ccccc2)C1=O
InChI=1SC26H27N3O2S2c1459142825(30)23(3326(28)32)16201729(21107681121)2724(20)19121322(313)18(2)1519h6810131517H45914H213H3b2316
MFCD03462191
ZINC000002671726
ZINC02671726
ZINC2671726
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