1-(3-bromophenyl)carbonyl-7-(1,4-diazepan-1-ylcarbonyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one

Systemtic Name: 1-(3-bromophenyl)carbonyl-7-(1,4-diazepan-1-ylcarbonyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 1-(3-bromobenzoyl)-7-(1,4-diazepane-1-carbonyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 1-[(3-bromophenyl)-oxomethyl]-7-[1,4-diazepan-1-yl(oxo)methyl]-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 1-(3-bromobenzoyl)-7-(1,4-diazepane-1-carbonyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 1-(3-bromobenzoyl)-7-(1,4-diazepane-1-carbonyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C28H27BrN4O3 MolecularWeight: 547.44298

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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=CC=C4)C(=O)C5=CC(=CC=C5)Br

Isomeric SMILES

C1CNCCN(C1)C(=O)C2=CC3=C(C=C2)N(C(CC(=O)N3)C4=CC=CC=C4)C(=O)C5=CC(=CC=C5)Br

InChI

InChI=1S/C28H27BrN4O3/c29-22-9-4-8-20(16-22)28(36)33-24-11-10-21(27(35)32-14-5-12-30-13-15-32)17-23(24)31-26(34)18-25(33)19-6-2-1-3-7-19/h1-4,6-11,16-17,25,30H,5,12-15,18H2,(H,31,34)