3-(2-methylphenyl)-4-[(E)-(4-phenylmethoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(2-methylphenyl)-4-[(E)-(4-phenylmethoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(4-benzyloxyphenyl)methyleneamino]-3-(o-tolyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(2-methylphenyl)-4-[(E)-(4-phenylmethoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(2-methylphenyl)-4-[(E)-(4-phenylmethoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(4-benzoxybenzylidene)amino]-3-(o-tolyl)-1H-1,2,4-triazole-5-thione Formula: C23H20N4OS MolecularWeight: 400.4961

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NNC(=S)N2N=CC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C2=NNC(=S)N2/N=C/C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C23H20N4OS/c1-17-7-5-6-10-21(17)22-25-26-23(29)27(22)24-15-18-11-13-20(14-12-18)28-16-19-8-3-2-4-9-19/h2-15H,16H2,1H3,(H,26,29)/b24-15+