1-(4-chlorophenyl)carbonyl-2-cyclohexyl-7-piperazin-1-ylcarbonyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one

Systemtic Name: 1-(4-chlorophenyl)carbonyl-2-cyclohexyl-7-piperazin-1-ylcarbonyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 1-(4-chlorobenzoyl)-2-cyclohexyl-7-(piperazine-1-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 1-[(4-chlorophenyl)-oxomethyl]-2-cyclohexyl-7-[oxo(1-piperazinyl)methyl]-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 1-(4-chlorobenzoyl)-2-cyclohexyl-7-(piperazine-1-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 1-(4-chlorobenzoyl)-2-cyclohexyl-7-(piperazine-1-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C27H31ClN4O3 MolecularWeight: 495.01304

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2CC(=O)NC3=C(N2C(=O)C4=CC=C(C=C4)Cl)C=CC(=C3)C(=O)N5CCNCC5

Isomeric SMILES

C1CCC(CC1)C2CC(=O)NC3=C(N2C(=O)C4=CC=C(C=C4)Cl)C=CC(=C3)C(=O)N5CCNCC5

InChI

InChI=1S/C27H31ClN4O3/c28-21-9-6-19(7-10-21)27(35)32-23-11-8-20(26(34)31-14-12-29-13-15-31)16-22(23)30-25(33)17-24(32)18-4-2-1-3-5-18/h6-11,16,18,24,29H,1-5,12-15,17H2,(H,30,33)