[(3S)-3-(azepan-1-yl)pyrrolidin-1-yl]-[4-(benzimidazol-1-yl)phenyl]methanone

Systemtic Name: [(3S)-3-(azepan-1-yl)pyrrolidin-1-yl]-[4-(benzimidazol-1-yl)phenyl]methanone Openeye Name: [(3S)-3-(azepan-1-yl)pyrrolidin-1-yl]-[4-(benzimidazol-1-yl)phenyl]methanone CAS Name: [(3S)-3-(1-azepanyl)-1-pyrrolidinyl]-[4-(1-benzimidazolyl)phenyl]methanone IUPAC Name: [(3S)-3-(azepan-1-yl)pyrrolidin-1-yl]-[4-(benzimidazol-1-yl)phenyl]methanone Traditional Name: [(3S)-3-(azepan-1-yl)pyrrolidino]-[4-(benzimidazol-1-yl)phenyl]methanone Formula: C24H28N4O MolecularWeight: 388.50532

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2CCN(C2)C(=O)C3=CC=C(C=C3)N4C=NC5=CC=CC=C54

Isomeric SMILES

C1CCCN(CC1)[C@H]2CCN(C2)C(=O)C3=CC=C(C=C3)N4C=NC5=CC=CC=C54

InChI

InChI=1S/C24H28N4O/c29-24(27-16-13-21(17-27)26-14-5-1-2-6-15-26)19-9-11-20(12-10-19)28-18-25-22-7-3-4-8-23(22)28/h3-4,7-12,18,21H,1-2,5-6,13-17H2/t21-/m0/s1