Vitas-M small molecule compound
2-bromo-6-methoxy-4-{(Z)-[6-oxo-2-(thiophen-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}phenyl acetate
Catalog ID
STK815733
SMILES COc1cc(cc(c1OC(=O)C)Br)/C=c/1\sc2n(c1=O)nc(n2)c1cccs1
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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 C18H12BrN3O4S2 MW 478.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12BrN3O4S2/c1-9(23)26-15-11(19)6-10(7-12(15)25-2)8-14-17(24)22-18(28-14)20-16(21-22)13-4-3-5-27-13/h3-8H,1-2H3/b14-8-InChIKey
HPXDSAQWMBRAKQ-ZSOIEALJSA-NSynonyms
(2BROMO6METHOXY4((Z)(6OXO2THIOPHEN2YL(13)THIAZOLO(32B)(124)TRIAZOL5YLIDENE)METHYL)PHENYL)ACETATE
2bromo6methoxy4((Z)(6oxo2(thiophen2yl)(13)thiazolo(32b)(124)triazol5(6H)ylidene)methyl)phenylacetate
CC(=O)OC1=C(C=C(C=C1Br)C=C2C(=O)N3C(=NC(=N3)C4=CC=CS4)S2)OC
COc1cc(cc(c1OC(=O)C)Br)C=c1sc2n(c1=O)nc(n2)c1cccs1
InChI=1SC18H12BrN3O4S2c19(23)261511(19)610(712(15)252)81417(24)2218(2814)2016(2122)134352713h38H12H3b148
MFCD03533208
ZINC000016732742
ZINC16732742
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