Vitas-M small molecule compound
5-{[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]methyl}-4-methyl-4H-1,2,4-triazole-3-thiol
Catalog ID
STK666102
SMILES Cc1ccc(c(c1)n1nc2c(n1)cccc2)OCc1nnc(n1C)S
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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 C17H16N6OS MW 352.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N6OS/c1-11-7-8-15(24-10-16-18-19-17(25)22(16)2)14(9-11)23-20-12-5-3-4-6-13(12)21-23/h3-9H,10H2,1-2H3,(H,19,25)InChIKey
LRQPAFSZMYHTOD-UHFFFAOYSA-NSynonyms
3((2(BENZOTRIAZOL2YL)4METHYLPHENOXY)METHYL)4METHYL1H124TRIAZOLE5THIONE
5((2(2Hbenzotriazol2yl)4methylphenoxy)methyl)4methyl4H124triazole3thiol
CC1=CC(=C(C=C1)OCC2=NNC(=S)N2C)N3N=C4C=CC=CC4=N3
InChI=1SC17H16N6OSc1117815(241016181917(25)22(16)2)14(911)232012534613(12)2123h39H10H212H3(H1925)
MFCD06616570
ZINC000004743240
ZINC4743240
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