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

Systemtic Name: 1-(4-methylphenyl)carbonyl-2-phenyl-7-piperazin-1-ylcarbonyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 1-(4-methylbenzoyl)-2-phenyl-7-(piperazine-1-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 1-[(4-methylphenyl)-oxomethyl]-7-[oxo(1-piperazinyl)methyl]-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 1-(4-methylbenzoyl)-2-phenyl-7-(piperazine-1-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 2-phenyl-7-(piperazine-1-carbonyl)-1-p-toluoyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C28H28N4O3 MolecularWeight: 468.54692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2C(CC(=O)NC3=C2C=CC(=C3)C(=O)N4CCNCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2C(CC(=O)NC3=C2C=CC(=C3)C(=O)N4CCNCC4)C5=CC=CC=C5

InChI

InChI=1S/C28H28N4O3/c1-19-7-9-21(10-8-19)28(35)32-24-12-11-22(27(34)31-15-13-29-14-16-31)17-23(24)30-26(33)18-25(32)20-5-3-2-4-6-20/h2-12,17,25,29H,13-16,18H2,1H3,(H,30,33)