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

Systemtic Name: 4-[(4-chlorophenyl)methyl]-3-[(1-methylpyrrol-2-yl)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(4-chlorophenyl)methyl]-3-[(1-methylpyrrol-2-yl)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-[(4-chlorophenyl)methyl]-3-[(1-methyl-2-pyrrolyl)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(4-chlorophenyl)methyl]-3-[(1-methylpyrrol-2-yl)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-(4-chlorobenzyl)-3-[(1-methylpyrrol-2-yl)methyl]-1H-1,2,4-triazole-5-thione Formula: C15H15ClN4S MolecularWeight: 318.8244

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CC2=NNC(=S)N2CC3=CC=C(C=C3)Cl

Isomeric SMILES

CN1C=CC=C1CC2=NNC(=S)N2CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H15ClN4S/c1-19-8-2-3-13(19)9-14-17-18-15(21)20(14)10-11-4-6-12(16)7-5-11/h2-8H,9-10H2,1H3,(H,18,21)