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

Systemtic Name: 1-cyclohexylcarbonyl-7-(1,4-diazepan-1-ylcarbonyl)-2-(4-methylphenyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 1-(cyclohexanecarbonyl)-7-(1,4-diazepane-1-carbonyl)-2-(p-tolyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 1-[cyclohexyl(oxo)methyl]-7-[1,4-diazepan-1-yl(oxo)methyl]-2-(4-methylphenyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 1-(cyclohexanecarbonyl)-7-(1,4-diazepane-1-carbonyl)-2-(4-methylphenyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 1-(cyclohexanecarbonyl)-7-(1,4-diazepane-1-carbonyl)-2-(p-tolyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C29H36N4O3 MolecularWeight: 488.62114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(=O)NC3=C(N2C(=O)C4CCCCC4)C=CC(=C3)C(=O)N5CCCNCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(=O)NC3=C(N2C(=O)C4CCCCC4)C=CC(=C3)C(=O)N5CCCNCC5

InChI

InChI=1S/C29H36N4O3/c1-20-8-10-21(11-9-20)26-19-27(34)31-24-18-23(28(35)32-16-5-14-30-15-17-32)12-13-25(24)33(26)29(36)22-6-3-2-4-7-22/h8-13,18,22,26,30H,2-7,14-17,19H2,1H3,(H,31,34)