1-[3-(3-fluorophenyl)phenyl]carbonyl-4-(pyridin-4-ylmethyl)-1,4-diazepan-5-one

Systemtic Name: 1-[3-(3-fluorophenyl)phenyl]carbonyl-4-(pyridin-4-ylmethyl)-1,4-diazepan-5-one Openeye Name: 1-[3-(3-fluorophenyl)benzoyl]-4-(4-pyridylmethyl)-1,4-diazepan-5-one CAS Name: 1-[[3-(3-fluorophenyl)phenyl]-oxomethyl]-4-(pyridin-4-ylmethyl)-1,4-diazepan-5-one IUPAC Name: 1-[3-(3-fluorophenyl)benzoyl]-4-(pyridin-4-ylmethyl)-1,4-diazepan-5-one Traditional Name: 1-[3-(3-fluorophenyl)benzoyl]-4-(4-pyridylmethyl)-1,4-diazepan-5-one Formula: C24H22FN3O2 MolecularWeight: 403.448783

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1=O)CC2=CC=NC=C2)C(=O)C3=CC=CC(=C3)C4=CC(=CC=C4)F

Isomeric SMILES

C1CN(CCN(C1=O)CC2=CC=NC=C2)C(=O)C3=CC=CC(=C3)C4=CC(=CC=C4)F

InChI

InChI=1S/C24H22FN3O2/c25-22-6-2-4-20(16-22)19-3-1-5-21(15-19)24(30)27-12-9-23(29)28(14-13-27)17-18-7-10-26-11-8-18/h1-8,10-11,15-16H,9,12-14,17H2