Vitas-M small molecule compound
2-methoxy-4-[(Z)-{2-[(E)-2-(4-methoxyphenyl)ethenyl]-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene}methyl]phenyl acetate
Catalog ID
STK904543
SMILES COc1cc(ccc1OC(=O)C)/C=c/1\sc2n(c1=O)nc(n2)/C=C/c1ccc(cc1)OC
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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 C23H19N3O5S MW 449.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O5S/c1-14(27)31-18-10-6-16(12-19(18)30-3)13-20-22(28)26-23(32-20)24-21(25-26)11-7-15-4-8-17(29-2)9-5-15/h4-13H,1-3H3/b11-7+,20-13-InChIKey
QLCYDYQZPZZDSA-KZBAPLJJSA-NSynonyms
(2methoxy4((Z)(2((E)2(4methoxyphenyl)ethenyl)6oxo(13)thiazolo(32b)(124)triazol5ylidene)methyl)phenyl)acetate
2methoxy4((Z)(2((E)2(4methoxyphenyl)ethenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)methyl)phenylacetate
CC(=O)OC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C=CC4=CC=C(C=C4)OC)S2)OC
COc1cc(ccc1OC(=O)C)C=c1sc2n(c1=O)nc(n2)C=Cc1ccc(cc1)OC
InChI=1SC23H19N3O5Sc114(27)311810616(1219(18)303)132022(28)2623(3220)2421(2526)117154817(292)9515h413H13H3b117+2013
MFCD18076107
ZINC000027022175
ZINC27022175
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