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

Systemtic Name: N-[(3,4-dichlorophenyl)methyl]-4-[2-oxidanylidene-3-(3-piperidin-1-ylpropyl)benzimidazol-1-yl]piperidine-1-carbothioamide Openeye Name: N-[(3,4-dichlorophenyl)methyl]-4-[2-oxo-3-[3-(1-piperidyl)propyl]benzimidazol-1-yl]piperidine-1-carbothioamide CAS Name: N-[(3,4-dichlorophenyl)methyl]-4-[2-oxo-3-[3-(1-piperidinyl)propyl]-1-benzimidazolyl]-1-piperidinecarbothioamide IUPAC Name: N-[(3,4-dichlorophenyl)methyl]-4-[2-oxo-3-(3-piperidin-1-ylpropyl)benzimidazol-1-yl]piperidine-1-carbothioamide Traditional Name: N-(3,4-dichlorobenzyl)-4-[2-keto-3-(3-piperidinopropyl)benzimidazol-1-yl]piperidine-1-carbothioamide Formula: C28H35Cl2N5OS MolecularWeight: 560.5814

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C28H35Cl2N5OS/c29-23-10-9-21(19-24(23)30)20-31-27(37)33-17-11-22(12-18-33)35-26-8-3-2-7-25(26)34(28(35)36)16-6-15-32-13-4-1-5-14-32/h2-3,7-10,19,22H,1,4-6,11-18,20H2,(H,31,37)