6-oxidanylidene-9-(2-oxidanylidene-1H-pyridin-4-yl)-N-(3-pyrrolidin-1-ylpropyl)-5,11-dihydrobenzo[b][1,4]benzodiazepine-3-carboxamide

Systemtic Name: 6-oxidanylidene-9-(2-oxidanylidene-1H-pyridin-4-yl)-N-(3-pyrrolidin-1-ylpropyl)-5,11-dihydrobenzo[b][1,4]benzodiazepine-3-carboxamide Openeye Name: 6-oxo-9-(2-oxo-1H-pyridin-4-yl)-N-(3-pyrrolidin-1-ylpropyl)-5,11-dihydrobenzo[b][1,4]benzodiazepine-3-carboxamide CAS Name: 6-oxo-9-(2-oxo-1H-pyridin-4-yl)-N-[3-(1-pyrrolidinyl)propyl]-5,11-dihydrobenzo[b][1,4]benzodiazepine-3-carboxamide IUPAC Name: 6-oxo-9-(2-oxo-1H-pyridin-4-yl)-N-(3-pyrrolidin-1-ylpropyl)-5,11-dihydrobenzo[b][1,4]benzodiazepine-3-carboxamide Traditional Name: 6-keto-9-(2-keto-1H-pyridin-4-yl)-N-(3-pyrrolidinopropyl)-5,11-dihydrobenzo[b][1,4]benzodiazepine-3-carboxamide Formula: C26H27N5O3 MolecularWeight: 457.52428

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCNC(=O)C2=CC3=C(C=C2)NC4=C(C=CC(=C4)C5=CC(=O)NC=C5)C(=O)N3

Isomeric SMILES

C1CCN(C1)CCCNC(=O)C2=CC3=C(C=C2)NC4=C(C=CC(=C4)C5=CC(=O)NC=C5)C(=O)N3

InChI

InChI=1S/C26H27N5O3/c32-24-16-18(8-10-27-24)17-4-6-20-22(14-17)29-21-7-5-19(15-23(21)30-26(20)34)25(33)28-9-3-13-31-11-1-2-12-31/h4-8,10,14-16,29H,1-3,9,11-13H2,(H,27,32)(H,28,33)(H,30,34)