Vitas-M small molecule compound
(5Z)-3-(2-methylpropyl)-5-{[1-phenyl-3-(2,4,6-trimethylphenyl)-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK808709
SMILES CC(CN1C(=S)S/C(=C\c2cn(nc2c2c(C)cc(cc2C)C)c2ccccc2)/C1=O)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 C26H27N3OS2 MW 461.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3OS2/c1-16(2)14-28-25(30)22(32-26(28)31)13-20-15-29(21-9-7-6-8-10-21)27-24(20)23-18(4)11-17(3)12-19(23)5/h6-13,15-16H,14H2,1-5H3/b22-13-InChIKey
CANLKSNAGNMGCZ-XKZIYDEJSA-NSynonyms
307953-09-9(5Z)3(2methylpropyl)5((1phenyl3(246trimethylphenyl)1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3(2METHYLPROPYL)5((1PHENYL3(246TRIMETHYLPHENYL)PYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
307953099
3ISOBUTYL5((3MESITYL1PHENYL1HPYRAZOL4YL)METHYLENE)2THIOXOTHIAZOLIDIN4ONE
CC(CN1C(=S)SC(=Cc2cn(nc2c2c(C)cc(cc2C)C)c2ccccc2)C1=O)C
CC1=CC(=C(C(=C1)C)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC(C)C)C4=CC=CC=C4)C
InChI=1SC26H27N3OS2c116(2)142825(30)22(3226(28)31)13201529(2197681021)2724(20)2318(4)1117(3)1219(23)5h6131516H14H215H3b2213
MFCD03461090
ZINC000002666930
ZINC02666930
ZINC2666930
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