1-[3,4-bis(fluoranyl)phenyl]carbonyl-2-(4-fluorophenyl)-7-piperazin-1-ylcarbonyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one

Systemtic Name: 1-[3,4-bis(fluoranyl)phenyl]carbonyl-2-(4-fluorophenyl)-7-piperazin-1-ylcarbonyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 1-(3,4-difluorobenzoyl)-2-(4-fluorophenyl)-7-(piperazine-1-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 1-[(3,4-difluorophenyl)-oxomethyl]-2-(4-fluorophenyl)-7-[oxo(1-piperazinyl)methyl]-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 1-(3,4-difluorobenzoyl)-2-(4-fluorophenyl)-7-(piperazine-1-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 1-(3,4-difluorobenzoyl)-2-(4-fluorophenyl)-7-(piperazine-1-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C27H23F3N4O3 MolecularWeight: 508.49173

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C2=CC3=C(C=C2)N(C(CC(=O)N3)C4=CC=C(C=C4)F)C(=O)C5=CC(=C(C=C5)F)F

Isomeric SMILES

C1CN(CCN1)C(=O)C2=CC3=C(C=C2)N(C(CC(=O)N3)C4=CC=C(C=C4)F)C(=O)C5=CC(=C(C=C5)F)F

InChI

InChI=1S/C27H23F3N4O3/c28-19-5-1-16(2-6-19)24-15-25(35)32-22-14-18(26(36)33-11-9-31-10-12-33)4-8-23(22)34(24)27(37)17-3-7-20(29)21(30)13-17/h1-8,13-14,24,31H,9-12,15H2,(H,32,35)