Vitas-M small molecule compound
(4Z)-2-(1,3-benzothiazol-2-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-4-(3,5-di-tert-butyl-4-hydroxybenzylidene)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK036692
SMILES Clc1ccc(cc1)SCC1=NN(C(=O)/C/1=C\c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)c1nc2c(s1)cccc2
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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 C32H32ClN3O2S2 MW 590.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32ClN3O2S2/c1-31(2,3)23-16-19(17-24(28(23)37)32(4,5)6)15-22-26(18-39-21-13-11-20(33)12-14-21)35-36(29(22)38)30-34-25-9-7-8-10-27(25)40-30/h7-17,37H,18H2,1-6H3/b22-15-InChIKey
WDYZZZUJKNQTLE-JCMHNJIXSA-NSynonyms
(4Z)2(13benzothiazol2yl)5(((4chlorophenyl)sulfanyl)methyl)4(35ditertbutyl4hydroxybenzylidene)24dihydro3Hpyrazol3one
Clc1ccc(cc1)SCC1=NN(C(=O)C1=Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)c1nc2c(s1)cccc2
MFCD04062388
STK036692
ZINC000100666477
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Check stock on Vitas-MAvailable files
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