1-methyl-N-[[2-[methyl(2-pyridin-2-ylethyl)amino]pyridin-3-yl]methyl]azepane-2-carboxamide

Systemtic Name: 1-methyl-N-[[2-[methyl(2-pyridin-2-ylethyl)amino]pyridin-3-yl]methyl]azepane-2-carboxamide Openeye Name: 1-methyl-N-[[2-[methyl-[2-(2-pyridyl)ethyl]amino]-3-pyridyl]methyl]azepane-2-carboxamide CAS Name: 1-methyl-N-[[2-[methyl-[2-(2-pyridinyl)ethyl]amino]-3-pyridinyl]methyl]-2-azepanecarboxamide IUPAC Name: 1-methyl-N-[[2-[methyl(2-pyridin-2-ylethyl)amino]pyridin-3-yl]methyl]azepane-2-carboxamide Traditional Name: 1-methyl-N-[[2-[methyl-[2-(2-pyridyl)ethyl]amino]-3-pyridyl]methyl]azepane-2-carboxamide Formula: C22H31N5O MolecularWeight: 381.51444

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCCCC1C(=O)NCC2=C(N=CC=C2)N(C)CCC3=CC=CC=N3

Isomeric SMILES

CN1CCCCCC1C(=O)NCC2=C(N=CC=C2)N(C)CCC3=CC=CC=N3

InChI

InChI=1S/C22H31N5O/c1-26-15-7-3-4-11-20(26)22(28)25-17-18-9-8-14-24-21(18)27(2)16-12-19-10-5-6-13-23-19/h5-6,8-10,13-14,20H,3-4,7,11-12,15-17H2,1-2H3,(H,25,28)