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

Systemtic Name: 5-(4-chlorophenyl)-2-[(4-oxidanylpiperidin-1-yl)methyl]-4-phenyl-1,2,4-triazole-3-thione Openeye Name: 5-(4-chlorophenyl)-2-[(4-hydroxy-1-piperidyl)methyl]-4-phenyl-1,2,4-triazole-3-thione CAS Name: 5-(4-chlorophenyl)-2-[(4-hydroxy-1-piperidinyl)methyl]-4-phenyl-1,2,4-triazole-3-thione IUPAC Name: 5-(4-chlorophenyl)-2-[(4-hydroxypiperidin-1-yl)methyl]-4-phenyl-1,2,4-triazole-3-thione Traditional Name: 5-(4-chlorophenyl)-2-[(4-hydroxypiperidino)methyl]-4-phenyl-1,2,4-triazole-3-thione Formula: C20H21ClN4OS MolecularWeight: 400.92494

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)CN2C(=S)N(C(=N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1O)CN2C(=S)N(C(=N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C20H21ClN4OS/c21-16-8-6-15(7-9-16)19-22-24(14-23-12-10-18(26)11-13-23)20(27)25(19)17-4-2-1-3-5-17/h1-9,18,26H,10-14H2