N-(1-cyanocyclohexyl)-N-methyl-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-(1-cyanocyclohexyl)-N-methyl-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanamide Openeye Name: 2-(4-benzyl-1,4-diazepan-1-yl)-N-(1-cyanocyclohexyl)-N-methyl-acetamide CAS Name: N-(1-cyanocyclohexyl)-N-methyl-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]acetamide IUPAC Name: 2-(4-benzyl-1,4-diazepan-1-yl)-N-(1-cyanocyclohexyl)-N-methylacetamide Traditional Name: 2-(4-benzyl-1,4-diazepan-1-yl)-N-(1-cyanocyclohexyl)-N-methyl-acetamide Formula: C22H32N4O MolecularWeight: 368.51568

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)CN1CCCN(CC1)CC2=CC=CC=C2)C3(CCCCC3)C#N

Isomeric SMILES

CN(C(=O)CN1CCCN(CC1)CC2=CC=CC=C2)C3(CCCCC3)C#N

InChI

InChI=1S/C22H32N4O/c1-24(22(19-23)11-6-3-7-12-22)21(27)18-26-14-8-13-25(15-16-26)17-20-9-4-2-5-10-20/h2,4-5,9-10H,3,6-8,11-18H2,1H3