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

Systemtic Name: 7-(1,4-diazepan-1-ylcarbonyl)-1-(4-methylphenyl)carbonyl-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 7-(1,4-diazepane-1-carbonyl)-1-(4-methylbenzoyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 7-[1,4-diazepan-1-yl(oxo)methyl]-1-[(4-methylphenyl)-oxomethyl]-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 7-(1,4-diazepane-1-carbonyl)-1-(4-methylbenzoyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 7-(1,4-diazepane-1-carbonyl)-2-phenyl-1-p-toluoyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C29H30N4O3 MolecularWeight: 482.5735

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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)N4CCCNCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2C(CC(=O)NC3=C2C=CC(=C3)C(=O)N4CCCNCC4)C5=CC=CC=C5

InChI

InChI=1S/C29H30N4O3/c1-20-8-10-22(11-9-20)29(36)33-25-13-12-23(28(35)32-16-5-14-30-15-17-32)18-24(25)31-27(34)19-26(33)21-6-3-2-4-7-21/h2-4,6-13,18,26,30H,5,14-17,19H2,1H3,(H,31,34)