Vitas-M small molecule compound
(5Z)-5-({3-[2-methyl-3-(2-methylpropoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-3-(2-methylpropyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK813199
SMILES CC(COc1cccc(c1C)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CC(C)C)c1ccccc1)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 C28H31N3O2S2 MW 505.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O2S2/c1-18(2)15-30-27(32)25(35-28(30)34)14-21-16-31(22-10-7-6-8-11-22)29-26(21)23-12-9-13-24(20(23)5)33-17-19(3)4/h6-14,16,18-19H,15,17H2,1-5H3/b25-14-InChIKey
HFAWDCGFZJRVDK-QFEZKATASA-NSynonyms
(5Z)5((3(2methyl3(2methylpropoxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)3(2methylpropyl)2thioxo13thiazolidin4one
(5Z)5((3(2METHYL3(2METHYLPROPOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3(2METHYLPROPYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
5((3(3ISOBUTOXY2METHYLPHENYL)1PHENYL1HPYRAZOL4YL)METHYLENE)3ISOBUTYL2THIOXOTHIAZOLIDIN4ONE
CC(COc1cccc(c1C)c1nn(cc1C=C1SC(=S)N(C1=O)CC(C)C)c1ccccc1)C
CC1=C(C=CC=C1OCC(C)C)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC(C)C)C4=CC=CC=C4
InChI=1SC28H31N3O2S2c118(2)153027(32)25(3528(30)34)14211631(22107681122)2926(21)231291324(20(23)5)331719(3)4h614161819H1517H215H3b2514
MFCD04441441
ZINC000002533103
ZINC02533103
ZINC2533103
Check stock
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Check stock on Vitas-MAvailable files
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