N-(diphenylmethyl)-4-[2-oxidanylidene-3-[3-(4-piperidin-1-ylpiperidin-1-yl)propyl]benzimidazol-1-yl]piperidine-1-carbothioamide

Systemtic Name: N-(diphenylmethyl)-4-[2-oxidanylidene-3-[3-(4-piperidin-1-ylpiperidin-1-yl)propyl]benzimidazol-1-yl]piperidine-1-carbothioamide Openeye Name: N-benzhydryl-4-[2-oxo-3-[3-[4-(1-piperidyl)-1-piperidyl]propyl]benzimidazol-1-yl]piperidine-1-carbothioamide CAS Name: N-(diphenylmethyl)-4-[2-oxo-3-[3-[4-(1-piperidinyl)-1-piperidinyl]propyl]-1-benzimidazolyl]-1-piperidinecarbothioamide IUPAC Name: N-benzhydryl-4-[2-oxo-3-[3-(4-piperidin-1-ylpiperidin-1-yl)propyl]benzimidazol-1-yl]piperidine-1-carbothioamide Traditional Name: N-benzhydryl-4-[2-keto-3-[3-(4-piperidinopiperidino)propyl]benzimidazol-1-yl]piperidine-1-carbothioamide Formula: C39H50N6OS MolecularWeight: 650.9189

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(CC2)CCCN3C4=CC=CC=C4N(C3=O)C5CCN(CC5)C(=S)NC(C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

C1CCN(CC1)C2CCN(CC2)CCCN3C4=CC=CC=C4N(C3=O)C5CCN(CC5)C(=S)NC(C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C39H50N6OS/c46-39-44(26-12-23-41-27-19-33(20-28-41)42-24-10-3-11-25-42)35-17-8-9-18-36(35)45(39)34-21-29-43(30-22-34)38(47)40-37(31-13-4-1-5-14-31)32-15-6-2-7-16-32/h1-2,4-9,13-18,33-34,37H,3,10-12,19-30H2,(H,40,47)