1-cyclopropylcarbonyl-7-(1,4-diazepan-1-ylcarbonyl)-2-(4-fluorophenyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one

Systemtic Name: 1-cyclopropylcarbonyl-7-(1,4-diazepan-1-ylcarbonyl)-2-(4-fluorophenyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 1-(cyclopropanecarbonyl)-7-(1,4-diazepane-1-carbonyl)-2-(4-fluorophenyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 1-[cyclopropyl(oxo)methyl]-7-[1,4-diazepan-1-yl(oxo)methyl]-2-(4-fluorophenyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 1-(cyclopropanecarbonyl)-7-(1,4-diazepane-1-carbonyl)-2-(4-fluorophenyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 1-(cyclopropanecarbonyl)-7-(1,4-diazepane-1-carbonyl)-2-(4-fluorophenyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C25H27FN4O3 MolecularWeight: 450.505283

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(=O)C2=CC3=C(C=C2)N(C(CC(=O)N3)C4=CC=C(C=C4)F)C(=O)C5CC5

Isomeric SMILES

C1CNCCN(C1)C(=O)C2=CC3=C(C=C2)N(C(CC(=O)N3)C4=CC=C(C=C4)F)C(=O)C5CC5

InChI

InChI=1S/C25H27FN4O3/c26-19-7-4-16(5-8-19)22-15-23(31)28-20-14-18(24(32)29-12-1-10-27-11-13-29)6-9-21(20)30(22)25(33)17-2-3-17/h4-9,14,17,22,27H,1-3,10-13,15H2,(H,28,31)