Vitas-M small molecule compound

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

Catalog ID
STK705597
SMILES Cc1ccccc1c1nn2c(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 C26H29N3O2S MW 447.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O2S/c1-15-10-8-9-11-17(15)22-27-24-29(28-22)23(31)20(32-24)14-16-12-18(25(2,3)4)21(30)19(13-16)26(5,6)7/h8-14,30H,1-7H3/b20-14-
InChIKey
LWFZRWQYPGFDKR-ZHZULCJRSA-N
Synonyms
585555-76-6
(5Z)5((35DITERTBUTYL4HYDROXYPHENYL)METHYLIDENE)2(2METHYLPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(35ditertbutyl4hydroxybenzylidene)2(2methylphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(Z)5(35ditertbutyl4hydroxybenzylidene)2(otolyl)thiazolo(32b)(124)triazol6(5H)one
585555766
CC1=CC=CC=C1C2=NN3C(=O)C(=CC4=CC(=C(C(=C4)C(C)(C)C)O)C(C)(C)C)SC3=N2
Cc1ccccc1c1nn2c(n1)sc(=Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)c2=O
InChI=1SC26H29N3O2Sc11510891117(15)22272429(2822)23(31)20(3224)14161218(25(23)4)21(30)19(1316)26(56)7h81430H17H3b2014
MFCD04028260
ZINC000002383587
ZINC02383587
ZINC2383587

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Available files

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