Vitas-M small molecule compound
4-bromo-2-{(E)-[2-(4-methylphenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}phenyl acetate
Catalog ID
STK822483
SMILES CC(=O)Oc1ccc(cc1/C=c\1/sc2n(c1=O)nc(n2)c1ccc(cc1)C)Br
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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 C20H14BrN3O3S MW 456.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14BrN3O3S/c1-11-3-5-13(6-4-11)18-22-20-24(23-18)19(26)17(28-20)10-14-9-15(21)7-8-16(14)27-12(2)25/h3-10H,1-2H3/b17-10+InChIKey
YTIFMOZWCGXDCB-LICLKQGHSA-NSynonyms
(4bromo2((E)(2(4methylphenyl)6oxo(13)thiazolo(32b)(124)triazol5ylidene)methyl)phenyl)acetate
4bromo2((E)(2(4methylphenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)methyl)phenylacetate
CC(=O)Oc1ccc(cc1C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)C)Br
CC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=C(C=CC(=C4)Br)OC(=O)C)SC3=N2
InChI=1SC20H14BrN3O3Sc1113513(6411)18222024(2318)19(26)17(2820)1014915(21)7816(14)2712(2)25h310H12H3b1710+
MFCD03212053
ZINC000027016585
ZINC27016585
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