Vitas-M small molecule compound

(5Z)-2-(3-chlorophenyl)-5-(3,5-di-tert-butyl-4-hydroxybenzylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one

Catalog ID
STK706061
SMILES Clc1cccc(c1)c1nn2c(n1)s/c(=C\c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)/c2=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 C25H26ClN3O2S MW 468.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26ClN3O2S/c1-24(2,3)17-10-14(11-18(20(17)30)25(4,5)6)12-19-22(31)29-23(32-19)27-21(28-29)15-8-7-9-16(26)13-15/h7-13,30H,1-6H3/b19-12-
InChIKey
LWXBSWRJQXGDAO-UNOMPAQXSA-N
Synonyms
714225-16-8
(5Z)2(3CHLOROPHENYL)5((35DITERTBUTYL4HYDROXYPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)2(3chlorophenyl)5(35ditertbutyl4hydroxybenzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(Z)2(3chlorophenyl)5(35ditertbutyl4hydroxybenzylidene)thiazolo(32b)(124)triazol6(5H)one
714225168
CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=C2C(=O)N3C(=NC(=N3)C4=CC(=CC=C4)Cl)S2
Clc1cccc(c1)c1nn2c(n1)sc(=Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)c2=O
InChI=1SC25H26ClN3O2Sc124(23)171014(1118(20(17)30)25(45)6)121922(31)2923(3219)2721(2829)1587916(26)1315h71330H16H3b1912
MFCD04010139
ZINC000001790712
ZINC01790712
ZINC1790712

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Available files

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