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

Systemtic Name: 2-cyclohexyl-7-(1,4-diazepan-1-ylcarbonyl)-1-(3-phenylpropanoyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 2-cyclohexyl-7-(1,4-diazepane-1-carbonyl)-1-(3-phenylpropanoyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 2-cyclohexyl-7-[1,4-diazepan-1-yl(oxo)methyl]-1-(1-oxo-3-phenylpropyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 2-cyclohexyl-7-(1,4-diazepane-1-carbonyl)-1-(3-phenylpropanoyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 2-cyclohexyl-7-(1,4-diazepane-1-carbonyl)-1-hydrocinnamoyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C30H38N4O3 MolecularWeight: 502.64772

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2CC(=O)NC3=C(N2C(=O)CCC4=CC=CC=C4)C=CC(=C3)C(=O)N5CCCNCC5

Isomeric SMILES

C1CCC(CC1)C2CC(=O)NC3=C(N2C(=O)CCC4=CC=CC=C4)C=CC(=C3)C(=O)N5CCCNCC5

InChI

InChI=1S/C30H38N4O3/c35-28-21-27(23-10-5-2-6-11-23)34(29(36)15-12-22-8-3-1-4-9-22)26-14-13-24(20-25(26)32-28)30(37)33-18-7-16-31-17-19-33/h1,3-4,8-9,13-14,20,23,27,31H,2,5-7,10-12,15-19,21H2,(H,32,35)