Vitas-M small molecule compound
(5Z)-5-({1-phenyl-3-[3-(piperidin-1-ylsulfonyl)phenyl]-1H-pyrazol-4-yl}methylidene)-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK904585
SMILES C=CCN1C(=S)S/C(=C\c2cn(nc2c2cccc(c2)S(=O)(=O)N2CCCCC2)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 C27H26N4O3S3 MW 550.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O3S3/c1-2-14-30-26(32)24(36-27(30)35)18-21-19-31(22-11-5-3-6-12-22)28-25(21)20-10-9-13-23(17-20)37(33,34)29-15-7-4-8-16-29/h2-3,5-6,9-13,17-19H,1,4,7-8,14-16H2/b24-18-InChIKey
PIDMFPQLIFAPFN-MOHJPFBDSA-NSynonyms
(5Z)5((1phenyl3(3(piperidin1ylsulfonyl)phenyl)1Hpyrazol4yl)methylidene)3(prop2en1yl)2thioxo13thiazolidin4one
(5Z)5((1phenyl3(3piperidin1ylsulfonylphenyl)pyrazol4yl)methylidene)3prop2enyl2sulfanylidene13thiazolidin4one
(Z)3allyl5((1phenyl3(3(piperidin1ylsulfonyl)phenyl)1Hpyrazol4yl)methylene)2thioxothiazolidin4one
C=CCN1C(=O)C(=CC2=CN(N=C2C3=CC(=CC=C3)S(=O)(=O)N4CCCCC4)C5=CC=CC=C5)SC1=S
C=CCN1C(=S)SC(=Cc2cn(nc2c2cccc(c2)S(=O)(=O)N2CCCCC2)c2ccccc2)C1=O
InChI=1SC27H26N4O3S3c12143026(32)24(3627(30)35)18211931(22115361222)2825(21)201091323(1720)37(3334)29157481629h23569131719H14781416H2b2418
MFCD04156563
ZINC000097947331
ZINC97947331
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