2-[[4-(3-methoxyphenyl)piperazin-1-yl]methyl]-4-phenyl-5-piperidin-1-yl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[4-(3-methoxyphenyl)piperazin-1-yl]methyl]-4-phenyl-5-piperidin-1-yl-1,2,4-triazole-3-thione Openeye Name: 2-[[4-(3-methoxyphenyl)piperazin-1-yl]methyl]-4-phenyl-5-(1-piperidyl)-1,2,4-triazole-3-thione CAS Name: 2-[[4-(3-methoxyphenyl)-1-piperazinyl]methyl]-4-phenyl-5-(1-piperidinyl)-1,2,4-triazole-3-thione IUPAC Name: 2-[[4-(3-methoxyphenyl)piperazin-1-yl]methyl]-4-phenyl-5-piperidin-1-yl-1,2,4-triazole-3-thione Traditional Name: 2-[[4-(3-methoxyphenyl)piperazino]methyl]-4-phenyl-5-piperidino-1,2,4-triazole-3-thione Formula: C25H32N6OS MolecularWeight: 464.62618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)CN3C(=S)N(C(=N3)N4CCCCC4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)CN3C(=S)N(C(=N3)N4CCCCC4)C5=CC=CC=C5

InChI

InChI=1S/C25H32N6OS/c1-32-23-12-8-11-22(19-23)28-17-15-27(16-18-28)20-30-25(33)31(21-9-4-2-5-10-21)24(26-30)29-13-6-3-7-14-29/h2,4-5,8-12,19H,3,6-7,13-18,20H2,1H3