N-[(4-chlorophenyl)methyl]-4-[2-oxidanylidene-3-(3-piperidin-1-ylpropyl)benzimidazol-1-yl]piperidine-1-carbothioamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-4-[2-oxidanylidene-3-(3-piperidin-1-ylpropyl)benzimidazol-1-yl]piperidine-1-carbothioamide Openeye Name: N-[(4-chlorophenyl)methyl]-4-[2-oxo-3-[3-(1-piperidyl)propyl]benzimidazol-1-yl]piperidine-1-carbothioamide CAS Name: N-[(4-chlorophenyl)methyl]-4-[2-oxo-3-[3-(1-piperidinyl)propyl]-1-benzimidazolyl]-1-piperidinecarbothioamide IUPAC Name: N-[(4-chlorophenyl)methyl]-4-[2-oxo-3-(3-piperidin-1-ylpropyl)benzimidazol-1-yl]piperidine-1-carbothioamide Traditional Name: N-(4-chlorobenzyl)-4-[2-keto-3-(3-piperidinopropyl)benzimidazol-1-yl]piperidine-1-carbothioamide Formula: C28H36ClN5OS MolecularWeight: 526.13634

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCN2C3=CC=CC=C3N(C2=O)C4CCN(CC4)C(=S)NCC5=CC=C(C=C5)Cl

Isomeric SMILES

C1CCN(CC1)CCCN2C3=CC=CC=C3N(C2=O)C4CCN(CC4)C(=S)NCC5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H36ClN5OS/c29-23-11-9-22(10-12-23)21-30-27(36)32-19-13-24(14-20-32)34-26-8-3-2-7-25(26)33(28(34)35)18-6-17-31-15-4-1-5-16-31/h2-3,7-12,24H,1,4-6,13-21H2,(H,30,36)