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

Systemtic Name: N-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]pyrazine-2-carboxamide Openeye Name: N-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]pyrazine-2-carboxamide CAS Name: N-[2-(1-azepanyl)-2-(1-methyl-2-pyrrolyl)ethyl]-2-pyrazinecarboxamide IUPAC Name: N-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]pyrazine-2-carboxamide Traditional Name: N-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]pyrazinamide Formula: C18H25N5O MolecularWeight: 327.424

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(CNC(=O)C2=NC=CN=C2)N3CCCCCC3

Isomeric SMILES

CN1C=CC=C1C(CNC(=O)C2=NC=CN=C2)N3CCCCCC3

InChI

InChI=1S/C18H25N5O/c1-22-10-6-7-16(22)17(23-11-4-2-3-5-12-23)14-21-18(24)15-13-19-8-9-20-15/h6-10,13,17H,2-5,11-12,14H2,1H3,(H,21,24)