Vitas-M small molecule compound
(5Z)-5-{[3-(4-methoxy-3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK701554
SMILES C=CCN1C(=S)S/C(=C\c2cn(nc2c2ccc(c(c2)[N+](=O)[O-])OC)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 C23H18N4O4S2 MW 478.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N4O4S2/c1-3-11-25-22(28)20(33-23(25)32)13-16-14-26(17-7-5-4-6-8-17)24-21(16)15-9-10-19(31-2)18(12-15)27(29)30/h3-10,12-14H,1,11H2,2H3/b20-13-InChIKey
CDSVSUWZDBBRAC-MOSHPQCFSA-NSynonyms
(5Z)5((3(4methoxy3nitrophenyl)1phenyl1Hpyrazol4yl)methylidene)3(prop2en1yl)2thioxo13thiazolidin4one
(5Z)5((3(4METHOXY3NITROPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN4ONE
C=CCN1C(=S)SC(=Cc2cn(nc2c2ccc(c(c2)(N+)(=O)(O))OC)c2ccccc2)C1=O
COC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC=C)C4=CC=CC=C4)(N+)(=O)(O)
InChI=1SC23H18N4O4S2c13112522(28)20(3323(25)32)13161426(177546817)2421(16)1591019(312)18(1215)27(29)30h3101214H111H22H3b2013
MFCD03461526
ZINC000016790990
ZINC16790990
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