2-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 2-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 2-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 2-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 2-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 2-(3-chlorobenzyl)-3-(4-methoxyphenyl)-1H-1,2,4-triazole-5-thione Formula: C16H14ClN3OS MolecularWeight: 331.81986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=S)NN2CC3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=S)NN2CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H14ClN3OS/c1-21-14-7-5-12(6-8-14)15-18-16(22)19-20(15)10-11-3-2-4-13(17)9-11/h2-9H,10H2,1H3,(H,19,22)