Vitas-M small molecule compound
(5E)-2-(4-methoxyphenyl)-5-[4-(propan-2-yl)benzylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK876595
SMILES COc1ccc(cc1)c1nc2n(n1)c(=O)/c(=C\c1ccc(cc1)C(C)C)/s2
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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 C21H19N3O2S MW 377.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O2S/c1-13(2)15-6-4-14(5-7-15)12-18-20(25)24-21(27-18)22-19(23-24)16-8-10-17(26-3)11-9-16/h4-13H,1-3H3/b18-12+InChIKey
HGXNBKZIPYYROC-LDADJPATSA-NSynonyms
(5E)2(4METHOXYPHENYL)5((4PROPAN2YLPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5E)2(4methoxyphenyl)5(4(propan2yl)benzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
2(4METHOXYPHENYL)5((4(PROPAN2YL)PHENYL)METHYLIDENE)5H6H(124)TRIAZOLO(32B)(13)THIAZOL6ONE
CC(C)C1=CC=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)OC)S2
COc1ccc(cc1)c1nc2n(n1)c(=O)c(=Cc1ccc(cc1)C(C)C)s2
InChI=1SC21H19N3O2Sc113(2)156414(5715)121820(25)2421(2718)2219(2324)1681017(263)11916h413H13H3b1812+
MFCD03089058
ZINC000000629001
ZINC00629001
ZINC629001
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