Vitas-M small molecule compound
(5Z)-5-{[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK809156
SMILES C=CCN1C(=S)S/C(=C\c2cn(nc2c2cccc(c2)[N+](=O)[O-])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 C22H16N4O3S2 MW 448.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N4O3S2/c1-2-11-24-21(27)19(31-22(24)30)13-16-14-25(17-8-4-3-5-9-17)23-20(16)15-7-6-10-18(12-15)26(28)29/h2-10,12-14H,1,11H2/b19-13-InChIKey
PFSCEENUJCNDHW-UYRXBGFRSA-NSynonyms
(5Z)5((3(3nitrophenyl)1phenyl1Hpyrazol4yl)methylidene)3(prop2en1yl)2thioxo13thiazolidin4one
(5Z)5((3(3nitrophenyl)1phenylpyrazol4yl)methylidene)3prop2enyl2sulfanylidene13thiazolidin4one
C=CCN1C(=O)C(=CC2=CN(N=C2C3=CC(=CC=C3)(N+)(=O)(O))C4=CC=CC=C4)SC1=S
C=CCN1C(=S)SC(=Cc2cn(nc2c2cccc(c2)(N+)(=O)(O))c2ccccc2)C1=O
InChI=1SC22H16N4O3S2c12112421(27)19(3122(24)30)13161425(178435917)2320(16)15761018(1215)26(28)29h2101214H111H2b1913
MFCD03461222
ZINC000001449346
ZINC01449346
ZINC1449346
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