2-(1,4-diazepan-1-yl)-N-(2-methyl-1-phenyl-propan-2-yl)pyridine-3-carboxamide

Systemtic Name: 2-(1,4-diazepan-1-yl)-N-(2-methyl-1-phenyl-propan-2-yl)pyridine-3-carboxamide Openeye Name: 2-(1,4-diazepan-1-yl)-N-(1,1-dimethyl-2-phenyl-ethyl)pyridine-3-carboxamide CAS Name: 2-(1,4-diazepan-1-yl)-N-(2-methyl-1-phenylpropan-2-yl)-3-pyridinecarboxamide IUPAC Name: 2-(1,4-diazepan-1-yl)-N-(2-methyl-1-phenylpropan-2-yl)pyridine-3-carboxamide Traditional Name: 2-(1,4-diazepan-1-yl)-N-(1,1-dimethyl-2-phenyl-ethyl)nicotinamide Formula: C21H28N4O MolecularWeight: 352.47322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=CC=C1)NC(=O)C2=C(N=CC=C2)N3CCCNCC3

Isomeric SMILES

CC(C)(CC1=CC=CC=C1)NC(=O)C2=C(N=CC=C2)N3CCCNCC3

InChI

InChI=1S/C21H28N4O/c1-21(2,16-17-8-4-3-5-9-17)24-20(26)18-10-6-12-23-19(18)25-14-7-11-22-13-15-25/h3-6,8-10,12,22H,7,11,13-16H2,1-2H3,(H,24,26)