1-phenyl-3-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]-4,5,6,7-tetrahydrobenzimidazole-2-thione

Systemtic Name: 1-phenyl-3-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]-4,5,6,7-tetrahydrobenzimidazole-2-thione Openeye Name: 1-phenyl-3-[[4-(4-pyridylmethyl)piperazin-1-yl]methyl]-4,5,6,7-tetrahydrobenzimidazole-2-thione CAS Name: 1-phenyl-3-[[4-(pyridin-4-ylmethyl)-1-piperazinyl]methyl]-4,5,6,7-tetrahydrobenzimidazole-2-thione IUPAC Name: 1-phenyl-3-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]-4,5,6,7-tetrahydrobenzimidazole-2-thione Traditional Name: 1-phenyl-3-[[4-(4-pyridylmethyl)piperazino]methyl]-4,5,6,7-tetrahydrobenzimidazole-2-thione Formula: C24H29N5S MolecularWeight: 419.58556

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N(C(=S)N2C3=CC=CC=C3)CN4CCN(CC4)CC5=CC=NC=C5

Isomeric SMILES

C1CCC2=C(C1)N(C(=S)N2C3=CC=CC=C3)CN4CCN(CC4)CC5=CC=NC=C5

InChI

InChI=1S/C24H29N5S/c30-24-28(19-27-16-14-26(15-17-27)18-20-10-12-25-13-11-20)22-8-4-5-9-23(22)29(24)21-6-2-1-3-7-21/h1-3,6-7,10-13H,4-5,8-9,14-19H2