4-(2,2-dimethylpropyl)-3-[2-oxidanylidene-2-(4-phenyl-1,4-diazepan-1-yl)ethyl]piperazin-2-one

Systemtic Name: 4-(2,2-dimethylpropyl)-3-[2-oxidanylidene-2-(4-phenyl-1,4-diazepan-1-yl)ethyl]piperazin-2-one Openeye Name: 4-(2,2-dimethylpropyl)-3-[2-oxo-2-(4-phenyl-1,4-diazepan-1-yl)ethyl]piperazin-2-one CAS Name: 4-(2,2-dimethylpropyl)-3-[2-oxo-2-(4-phenyl-1,4-diazepan-1-yl)ethyl]-2-piperazinone IUPAC Name: 4-(2,2-dimethylpropyl)-3-[2-oxo-2-(4-phenyl-1,4-diazepan-1-yl)ethyl]piperazin-2-one Traditional Name: 3-[2-keto-2-(4-phenyl-1,4-diazepan-1-yl)ethyl]-4-neopentyl-piperazin-2-one Formula: C22H34N4O2 MolecularWeight: 386.53096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1CCNC(=O)C1CC(=O)N2CCCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)CN1CCNC(=O)C1CC(=O)N2CCCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C22H34N4O2/c1-22(2,3)17-26-13-10-23-21(28)19(26)16-20(27)25-12-7-11-24(14-15-25)18-8-5-4-6-9-18/h4-6,8-9,19H,7,10-17H2,1-3H3,(H,23,28)