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

Systemtic Name: 2-cyclohexyl-1-(phenylcarbonyl)-7-piperazin-1-ylcarbonyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 1-benzoyl-2-cyclohexyl-7-(piperazine-1-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 1-benzoyl-2-cyclohexyl-7-[oxo(1-piperazinyl)methyl]-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 1-benzoyl-2-cyclohexyl-7-(piperazine-1-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 1-benzoyl-2-cyclohexyl-7-(piperazine-1-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C27H32N4O3 MolecularWeight: 460.56798

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H32N4O3/c32-25-18-24(19-7-3-1-4-8-19)31(27(34)20-9-5-2-6-10-20)23-12-11-21(17-22(23)29-25)26(33)30-15-13-28-14-16-30/h2,5-6,9-12,17,19,24,28H,1,3-4,7-8,13-16,18H2,(H,29,32)