N-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]quinoxaline-2-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]quinoxaline-2-carboxamide Openeye Name: N-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]quinoxaline-2-carboxamide CAS Name: N-[2-(1-azepanyl)-2-(1-methyl-2-pyrrolyl)ethyl]-2-quinoxalinecarboxamide IUPAC Name: N-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]quinoxaline-2-carboxamide Traditional Name: N-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]quinoxaline-2-carboxamide Formula: C22H27N5O MolecularWeight: 377.48268

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(CNC(=O)C2=NC3=CC=CC=C3N=C2)N4CCCCCC4

Isomeric SMILES

CN1C=CC=C1C(CNC(=O)C2=NC3=CC=CC=C3N=C2)N4CCCCCC4

InChI

InChI=1S/C22H27N5O/c1-26-12-8-11-20(26)21(27-13-6-2-3-7-14-27)16-24-22(28)19-15-23-17-9-4-5-10-18(17)25-19/h4-5,8-12,15,21H,2-3,6-7,13-14,16H2,1H3,(H,24,28)