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

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

C1CCC(C(C1)N)NC(=O)C2=CC3=C(C=C2)N(C(CC(=O)N3)C4=C(C=C(C=C4)Cl)Cl)C(=O)C5CC5

Isomeric SMILES

C1CCC(C(C1)N)NC(=O)C2=CC3=C(C=C2)N(C(CC(=O)N3)C4=C(C=C(C=C4)Cl)Cl)C(=O)C5CC5

InChI

InChI=1S/C26H28Cl2N4O3/c27-16-8-9-17(18(28)12-16)23-13-24(33)30-21-11-15(25(34)31-20-4-2-1-3-19(20)29)7-10-22(21)32(23)26(35)14-5-6-14/h7-12,14,19-20,23H,1-6,13,29H2,(H,30,33)(H,31,34)