Vitas-M small molecule compound
(5Z)-5-{[3-(2-methyl-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-pentyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK799145
SMILES CCCCCN1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2C)OCCC)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 C28H31N3O2S2 MW 505.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O2S2/c1-4-6-10-15-30-27(32)25(35-28(30)34)18-21-19-31(22-11-8-7-9-12-22)29-26(21)24-14-13-23(17-20(24)3)33-16-5-2/h7-9,11-14,17-19H,4-6,10,15-16H2,1-3H3/b25-18-InChIKey
OIACAXDJZBTGTQ-BWAHOGKJSA-NSynonyms
955898-75-6(5Z)5((3(2methyl4propoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)3pentyl2thioxo13thiazolidin4one
(5Z)5((3(2methyl4propoxyphenyl)1phenylpyrazol4yl)methylidene)3pentyl2sulfanylidene13thiazolidin4one
(Z)5((3(2methyl4propoxyphenyl)1phenyl1Hpyrazol4yl)methylene)3pentyl2thioxothiazolidin4one
955898756
CCCCCN1C(=O)C(=CC2=CN(N=C2C3=C(C=C(C=C3)OCCC)C)C4=CC=CC=C4)SC1=S
CCCCCN1C(=S)SC(=Cc2cn(nc2c2ccc(cc2C)OCCC)c2ccccc2)C1=O
InChI=1SC28H31N3O2S2c14610153027(32)25(3528(30)34)18211931(22118791222)2926(21)24141323(1720(24)3)331652h7911141719H46101516H213H3b2518
MFCD03418115
ZINC000009427887
ZINC09427887
ZINC9427887
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