3-[1-[2-[(4S)-1-pyridin-3-ylcarbonylazepan-4-yl]ethyl]piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[2-[(4S)-1-pyridin-3-ylcarbonylazepan-4-yl]ethyl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[2-[(4S)-1-(pyridine-3-carbonyl)azepan-4-yl]ethyl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[2-[(4S)-1-[oxo(3-pyridinyl)methyl]-4-azepanyl]ethyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[2-[(4S)-1-(pyridine-3-carbonyl)azepan-4-yl]ethyl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[2-[(4S)-1-nicotinoylazepan-4-yl]ethyl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C26H33N5O2 MolecularWeight: 447.57252

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCN(C1)C(=O)C2=CN=CC=C2)CCN3CCC(CC3)N4C5=CC=CC=C5NC4=O

Isomeric SMILES

C1C[C@H](CCN(C1)C(=O)C2=CN=CC=C2)CCN3CCC(CC3)N4C5=CC=CC=C5NC4=O

InChI

InChI=1S/C26H33N5O2/c32-25(21-6-3-13-27-19-21)30-14-4-5-20(10-18-30)9-15-29-16-11-22(12-17-29)31-24-8-2-1-7-23(24)28-26(31)33/h1-3,6-8,13,19-20,22H,4-5,9-12,14-18H2,(H,28,33)/t20-/m0/s1