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

Systemtic Name: 4-[(E)-(3-bromophenyl)methylideneamino]-3-(3-methoxyphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(3-bromophenyl)methyleneamino]-3-(3-methoxyphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-(3-bromophenyl)methylideneamino]-3-(3-methoxyphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-(3-bromophenyl)methylideneamino]-3-(3-methoxyphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(3-bromobenzylidene)amino]-3-(3-methoxyphenyl)-1H-1,2,4-triazole-5-thione Formula: C16H13BrN4OS MolecularWeight: 389.26962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NNC(=S)N2N=CC3=CC(=CC=C3)Br

Isomeric SMILES

COC1=CC=CC(=C1)C2=NNC(=S)N2/N=C/C3=CC(=CC=C3)Br

InChI

InChI=1S/C16H13BrN4OS/c1-22-14-7-3-5-12(9-14)15-19-20-16(23)21(15)18-10-11-4-2-6-13(17)8-11/h2-10H,1H3,(H,20,23)/b18-10+