Vitas-M small molecule compound
(5Z)-2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-5-(2-methoxybenzylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK904867
SMILES COc1cc(/C=C/c2nn3c(n2)s/c(=C\c2ccccc2OC)/c3=O)ccc1OC
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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 C22H19N3O4S MW 421.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O4S/c1-27-16-7-5-4-6-15(16)13-19-21(26)25-22(30-19)23-20(24-25)11-9-14-8-10-17(28-2)18(12-14)29-3/h4-13H,1-3H3/b11-9+,19-13-InChIKey
FRYGOSZFFRBLRG-YOAWELAASA-NSynonyms
(5Z)2((E)2(34dimethoxyphenyl)ethenyl)5((2methoxyphenyl)methylidene)(13)thiazolo(32b)(124)triazol6one
(5Z)2((E)2(34dimethoxyphenyl)ethenyl)5(2methoxybenzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
COC1=C(C=C(C=C1)C=CC2=NN3C(=O)C(=CC4=CC=CC=C4OC)SC3=N2)OC
COc1cc(C=Cc2nn3c(n2)sc(=Cc2ccccc2OC)c3=O)ccc1OC
InChI=1SC22H19N3O4Sc12716754615(16)131921(26)2522(3019)2320(2425)1191481017(282)18(1214)293h413H13H3b119+1913
MFCD07496786
ZINC000027022547
ZINC27022547
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