Vitas-M small molecule compound
2-methoxy-4-[(Z)-{2-[(E)-2-(4-methylphenyl)ethenyl]-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene}methyl]phenyl acetate
Catalog ID
STK800068
SMILES COc1cc(ccc1OC(=O)C)/C=c/1\sc2n(c1=O)nc(n2)/C=C/c1ccc(cc1)C
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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 C23H19N3O4S MW 433.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O4S/c1-14-4-6-16(7-5-14)9-11-21-24-23-26(25-21)22(28)20(31-23)13-17-8-10-18(30-15(2)27)19(12-17)29-3/h4-13H,1-3H3/b11-9+,20-13-InChIKey
CNIDKYOGSOKBBH-ALNGHYEBSA-NSynonyms
(2methoxy4((Z)(2((E)2(4methylphenyl)ethenyl)6oxo(13)thiazolo(32b)(124)triazol5ylidene)methyl)phenyl)acetate
2methoxy4((Z)(2((E)2(4methylphenyl)ethenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)methyl)phenylacetate
CC1=CC=C(C=C1)C=CC2=NN3C(=O)C(=CC4=CC(=C(C=C4)OC(=O)C)OC)SC3=N2
COc1cc(ccc1OC(=O)C)C=c1sc2n(c1=O)nc(n2)C=Cc1ccc(cc1)C
InChI=1SC23H19N3O4Sc1144616(7514)91121242326(2521)22(28)20(3123)131781018(3015(2)27)19(1217)293h413H13H3b119+2013
MFCD04447041
ZINC000009972190
ZINC09972190
ZINC9972190
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