N-(4-azanylcyclohexyl)-1-cyclopropylcarbonyl-2-(2,4-dichlorophenyl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-cyclopropylcarbonyl-2-(2,4-dichlorophenyl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(cyclopropanecarbonyl)-2-(2,4-dichlorophenyl)-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[cyclopropyl(oxo)methyl]-2-(2,4-dichlorophenyl)-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(cyclopropanecarbonyl)-2-(2,4-dichlorophenyl)-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-(cyclopropanecarbonyl)-2-(2,4-dichlorophenyl)-4-keto-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Formula: C26H28Cl2N4O3 MolecularWeight: 515.43152

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2C(CC(=O)NC3=C2C=CC(=C3)C(=O)NC4CCC(CC4)N)C5=C(C=C(C=C5)Cl)Cl

Isomeric SMILES

C1CC1C(=O)N2C(CC(=O)NC3=C2C=CC(=C3)C(=O)NC4CCC(CC4)N)C5=C(C=C(C=C5)Cl)Cl

InChI

InChI=1S/C26H28Cl2N4O3/c27-16-4-9-19(20(28)12-16)23-13-24(33)31-21-11-15(25(34)30-18-7-5-17(29)6-8-18)3-10-22(21)32(23)26(35)14-1-2-14/h3-4,9-12,14,17-18,23H,1-2,5-8,13,29H2,(H,30,34)(H,31,33)