Vitas-M small molecule compound
(5Z)-5-{[1-phenyl-3-(2,4,6-trimethylphenyl)-1H-pyrazol-4-yl]methylidene}-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK809153
SMILES C=CCN1C(=S)S/C(=C\c2cn(nc2c2c(C)cc(cc2C)C)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 C25H23N3OS2 MW 445.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3OS2/c1-5-11-27-24(29)21(31-25(27)30)14-19-15-28(20-9-7-6-8-10-20)26-23(19)22-17(3)12-16(2)13-18(22)4/h5-10,12-15H,1,11H2,2-4H3/b21-14-InChIKey
YPFSBZWLDOGRRX-STZFKDTASA-NSynonyms
(5Z)5((1phenyl3(246trimethylphenyl)1Hpyrazol4yl)methylidene)3(prop2en1yl)2thioxo13thiazolidin4one
(5Z)5((1PHENYL3(246TRIMETHYLPHENYL)PYRAZOL4YL)METHYLIDENE)3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN4ONE
C=CCN1C(=S)SC(=Cc2cn(nc2c2c(C)cc(cc2C)C)c2ccccc2)C1=O
CC1=CC(=C(C(=C1)C)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC=C)C4=CC=CC=C4)C
InChI=1SC25H23N3OS2c15112724(29)21(3125(27)30)14191528(2097681020)2623(19)2217(3)1216(2)1318(22)4h5101215H111H224H3b2114
MFCD03461219
ZINC000002672937
ZINC02672937
ZINC2672937
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