11-[3-(3-pyrrolidin-1-ylpropyl)azepan-1-yl]carbonyl-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one

Systemtic Name: 11-[3-(3-pyrrolidin-1-ylpropyl)azepan-1-yl]carbonyl-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one Openeye Name: 11-[3-(3-pyrrolidin-1-ylpropyl)azepane-1-carbonyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one CAS Name: 11-[oxo-[3-[3-(1-pyrrolidinyl)propyl]-1-azepanyl]methyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one IUPAC Name: 11-[3-(3-pyrrolidin-1-ylpropyl)azepane-1-carbonyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one Traditional Name: 11-[3-(3-pyrrolidinopropyl)azepane-1-carbonyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one Formula: C26H33N5O2 MolecularWeight: 447.57252

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC(C1)CCCN2CCCC2)C(=O)N3C4=CC=CC=C4C(=O)NC5=C3N=CC=C5

Isomeric SMILES

C1CCN(CC(C1)CCCN2CCCC2)C(=O)N3C4=CC=CC=C4C(=O)NC5=C3N=CC=C5

InChI

InChI=1S/C26H33N5O2/c32-25-21-11-1-2-13-23(21)31(24-22(28-25)12-7-14-27-24)26(33)30-18-4-3-9-20(19-30)10-8-17-29-15-5-6-16-29/h1-2,7,11-14,20H,3-6,8-10,15-19H2,(H,28,32)