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

Systemtic Name: 1-(3-bromophenyl)carbonyl-2-(4-fluorophenyl)-7-piperazin-1-ylcarbonyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 1-(3-bromobenzoyl)-2-(4-fluorophenyl)-7-(piperazine-1-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 1-[(3-bromophenyl)-oxomethyl]-2-(4-fluorophenyl)-7-[oxo(1-piperazinyl)methyl]-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 1-(3-bromobenzoyl)-2-(4-fluorophenyl)-7-(piperazine-1-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 1-(3-bromobenzoyl)-2-(4-fluorophenyl)-7-(piperazine-1-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C27H24BrFN4O3 MolecularWeight: 551.406863

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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(=CC=C5)Br

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(=CC=C5)Br

InChI

InChI=1S/C27H24BrFN4O3/c28-20-3-1-2-18(14-20)27(36)33-23-9-6-19(26(35)32-12-10-30-11-13-32)15-22(23)31-25(34)16-24(33)17-4-7-21(29)8-5-17/h1-9,14-15,24,30H,10-13,16H2,(H,31,34)