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

Systemtic Name: 7-(1,4-diazepan-1-ylcarbonyl)-2-(4-methylphenyl)-1-(3-phenylpropanoyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 7-(1,4-diazepane-1-carbonyl)-1-(3-phenylpropanoyl)-2-(p-tolyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 7-[1,4-diazepan-1-yl(oxo)methyl]-2-(4-methylphenyl)-1-(1-oxo-3-phenylpropyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 7-(1,4-diazepane-1-carbonyl)-2-(4-methylphenyl)-1-(3-phenylpropanoyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 7-(1,4-diazepane-1-carbonyl)-1-hydrocinnamoyl-2-(p-tolyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C31H34N4O3 MolecularWeight: 510.62666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(=O)NC3=C(N2C(=O)CCC4=CC=CC=C4)C=CC(=C3)C(=O)N5CCCNCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(=O)NC3=C(N2C(=O)CCC4=CC=CC=C4)C=CC(=C3)C(=O)N5CCCNCC5

InChI

InChI=1S/C31H34N4O3/c1-22-8-11-24(12-9-22)28-21-29(36)33-26-20-25(31(38)34-18-5-16-32-17-19-34)13-14-27(26)35(28)30(37)15-10-23-6-3-2-4-7-23/h2-4,6-9,11-14,20,28,32H,5,10,15-19,21H2,1H3,(H,33,36)