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

Systemtic Name: 3-[(4-chlorophenyl)methyl]-4-(2,5-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(4-chlorophenyl)methyl]-4-(2,5-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[(4-chlorophenyl)methyl]-4-(2,5-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(4-chlorophenyl)methyl]-4-(2,5-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(4-chlorobenzyl)-4-(2,5-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione Formula: C17H16ClN3O2S MolecularWeight: 361.84584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N2C(=NNC2=S)CC3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N2C(=NNC2=S)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H16ClN3O2S/c1-22-13-7-8-15(23-2)14(10-13)21-16(19-20-17(21)24)9-11-3-5-12(18)6-4-11/h3-8,10H,9H2,1-2H3,(H,20,24)