Vitas-M small molecule compound
(5Z)-5-(2-ethoxybenzylidene)-2-[(E)-2-(4-methylphenyl)ethenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK800072
SMILES CCOc1ccccc1/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 C22H19N3O2S MW 389.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O2S/c1-3-27-18-7-5-4-6-17(18)14-19-21(26)25-22(28-19)23-20(24-25)13-12-16-10-8-15(2)9-11-16/h4-14H,3H2,1-2H3/b13-12+,19-14-InChIKey
IMKRYUUAUHRAKP-OZGAEJQKSA-NSynonyms
(5Z)5((2ethoxyphenyl)methylidene)2((E)2(4methylphenyl)ethenyl)(13)thiazolo(32b)(124)triazol6one
(5Z)5(2ethoxybenzylidene)2((E)2(4methylphenyl)ethenyl)(13)thiazolo(32b)(124)triazol6(5H)one
CCOC1=CC=CC=C1C=C2C(=O)N3C(=NC(=N3)C=CC4=CC=C(C=C4)C)S2
CCOc1ccccc1C=c1sc2n(c1=O)nc(n2)C=Cc1ccc(cc1)C
InChI=1SC22H19N3O2Sc132718754617(18)141921(26)2522(2819)2320(2425)13121610815(2)91116h414H3H212H3b1312+1914
MFCD04447044
ZINC000016735422
ZINC16735422
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