Vitas-M small molecule compound
4-{(E)-[2-(4-methoxyphenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}phenyl acetate
Catalog ID
STK797632
SMILES COc1ccc(cc1)c1nn2c(n1)s/c(=C/c1ccc(cc1)OC(=O)C)/c2=O
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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 C20H15N3O4S MW 393.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15N3O4S/c1-12(24)27-16-7-3-13(4-8-16)11-17-19(25)23-20(28-17)21-18(22-23)14-5-9-15(26-2)10-6-14/h3-11H,1-2H3/b17-11+InChIKey
HGLMWCMJIVOHQB-GZTJUZNOSA-NSynonyms
(4((E)(2(4METHOXYPHENYL)6OXO(13)THIAZOLO(32B)(124)TRIAZOL5YLIDENE)METHYL)PHENYL)ACETATE
4((E)(2(4methoxyphenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)methyl)phenylacetate
CC(=O)OC1=CC=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)OC)S2
COc1ccc(cc1)c1nn2c(n1)sc(=Cc1ccc(cc1)OC(=O)C)c2=O
InChI=1SC20H15N3O4Sc112(24)27167313(4816)111719(25)2320(2817)2118(2223)145915(262)10614h311H12H3b1711+
MFCD03417095
ZINC000002699602
ZINC02699602
ZINC2699602
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