Vitas-M small molecule compound
(5Z)-3-(butan-2-yl)-5-{[3-(4-methoxy-2-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK811802
SMILES CCC(N1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2C)OC)c2ccccc2)/C1=O)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 C25H25N3O2S2 MW 463.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O2S2/c1-5-17(3)28-24(29)22(32-25(28)31)14-18-15-27(19-9-7-6-8-10-19)26-23(18)21-12-11-20(30-4)13-16(21)2/h6-15,17H,5H2,1-4H3/b22-14-InChIKey
DMVNNKZMYVPRGK-HMAPJEAMSA-NSynonyms
(5Z)3(butan2yl)5((3(4methoxy2methylphenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3butan2yl5((3(4methoxy2methylphenyl)1phenylpyrazol4yl)methylidene)2sulfanylidene13thiazolidin4one
CCC(C)N1C(=O)C(=CC2=CN(N=C2C3=C(C=C(C=C3)OC)C)C4=CC=CC=C4)SC1=S
CCC(N1C(=S)SC(=Cc2cn(nc2c2ccc(cc2C)OC)c2ccccc2)C1=O)C
InChI=1SC25H25N3O2S2c1517(3)2824(29)22(3225(28)31)14181527(1997681019)2623(18)21121120(304)1316(21)2h61517H5H214H3b2214
MFCD06264936
ZINC000016805177
ZINC000016805179
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