Vitas-M small molecule compound
(5Z)-2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-5-(3-methoxybenzylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK904865
SMILES COc1cccc(c1)/C=c/1\sc2n(c1=O)nc(n2)/C=C/c1ccc(c(c1)OC)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 C22H19N3O4S MW 421.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O4S/c1-27-16-6-4-5-15(11-16)13-19-21(26)25-22(30-19)23-20(24-25)10-8-14-7-9-17(28-2)18(12-14)29-3/h4-13H,1-3H3/b10-8+,19-13-InChIKey
UVODXLAQWJDWLH-ROOVKVKRSA-NSynonyms
(5Z)2((E)2(34dimethoxyphenyl)ethenyl)5((3methoxyphenyl)methylidene)(13)thiazolo(32b)(124)triazol6one
(5Z)2((E)2(34dimethoxyphenyl)ethenyl)5(3methoxybenzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
COC1=C(C=C(C=C1)C=CC2=NN3C(=O)C(=CC4=CC(=CC=C4)OC)SC3=N2)OC
COc1cccc(c1)C=c1sc2n(c1=O)nc(n2)C=Cc1ccc(c(c1)OC)OC
InChI=1SC22H19N3O4Sc1271664515(1116)131921(26)2522(3019)2320(2425)108147917(282)18(1214)293h413H13H3b108+1913
MFCD07496787
ZINC000027022537
ZINC27022537
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