Vitas-M small molecule compound
2-bromo-4-{(Z)-[2-(furan-2-yl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}-6-methoxyphenyl acetate
Catalog ID
STK819030
SMILES COc1cc(cc(c1OC(=O)C)Br)/C=c/1\sc2n(c1=O)nc(n2)c1ccco1
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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 C18H12BrN3O5S MW 462.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12BrN3O5S/c1-9(23)27-15-11(19)6-10(7-13(15)25-2)8-14-17(24)22-18(28-14)20-16(21-22)12-4-3-5-26-12/h3-8H,1-2H3/b14-8-InChIKey
YMPGEJSFJGFJLH-ZSOIEALJSA-NSynonyms
(2BROMO4((Z)(2(FURAN2YL)6OXO(13)THIAZOLO(32B)(124)TRIAZOL5YLIDENE)METHYL)6METHOXYPHENYL)ACETATE
2bromo4((Z)(2(furan2yl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)methyl)6methoxyphenylacetate
CC(=O)OC1=C(C=C(C=C1Br)C=C2C(=O)N3C(=NC(=N3)C4=CC=CO4)S2)OC
COc1cc(cc(c1OC(=O)C)Br)C=c1sc2n(c1=O)nc(n2)c1ccco1
InChI=1SC18H12BrN3O5Sc19(23)271511(19)610(713(15)252)81417(24)2218(2814)2016(2122)124352612h38H12H3b148
MFCD04448165
ZINC000016737152
ZINC16737152
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