3-[[2-(benzotriazol-2-yl)-4-methyl-phenoxy]methyl]-4-methyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[[2-(benzotriazol-2-yl)-4-methyl-phenoxy]methyl]-4-methyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[[2-(benzotriazol-2-yl)-4-methyl-phenoxy]methyl]-4-methyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[[2-(2-benzotriazolyl)-4-methylphenoxy]methyl]-4-methyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[[2-(benzotriazol-2-yl)-4-methylphenoxy]methyl]-4-methyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[[2-(benzotriazol-2-yl)-4-methyl-phenoxy]methyl]-4-methyl-1H-1,2,4-triazole-5-thione Formula: C17H16N6OS MolecularWeight: 352.41354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2=NNC(=S)N2C)N3N=C4C=CC=CC4=N3

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2=NNC(=S)N2C)N3N=C4C=CC=CC4=N3

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)