2-[3-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-3-oxidanylidene-propyl]-1H-quinazolin-4-one

Systemtic Name: 2-[3-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-3-oxidanylidene-propyl]-1H-quinazolin-4-one Openeye Name: 2-[3-[4-(azepane-1-carbonyl)-1-piperidyl]-3-oxo-propyl]-1H-quinazolin-4-one CAS Name: 2-[3-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-3-oxopropyl]-1H-quinazolin-4-one IUPAC Name: 2-[3-[4-(azepane-1-carbonyl)piperidin-1-yl]-3-oxopropyl]-1H-quinazolin-4-one Traditional Name: 2-[3-[4-(azepane-1-carbonyl)piperidino]-3-keto-propyl]-1H-quinazolin-4-one Formula: C23H30N4O3 MolecularWeight: 410.5093

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)CCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)CCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C23H30N4O3/c28-21(10-9-20-24-19-8-4-3-7-18(19)22(29)25-20)26-15-11-17(12-16-26)23(30)27-13-5-1-2-6-14-27/h3-4,7-8,17H,1-2,5-6,9-16H2,(H,24,25,29)