N-hexyl-N-[3-oxidanylidene-3-(pyridin-2-ylmethylamino)propyl]pyrazine-2-carboxamide

Systemtic Name: N-hexyl-N-[3-oxidanylidene-3-(pyridin-2-ylmethylamino)propyl]pyrazine-2-carboxamide Openeye Name: N-hexyl-N-[3-oxo-3-(2-pyridylmethylamino)propyl]pyrazine-2-carboxamide CAS Name: N-hexyl-N-[3-oxo-3-(2-pyridinylmethylamino)propyl]-2-pyrazinecarboxamide IUPAC Name: N-hexyl-N-[3-oxo-3-(pyridin-2-ylmethylamino)propyl]pyrazine-2-carboxamide Traditional Name: N-hexyl-N-[3-keto-3-(2-pyridylmethylamino)propyl]pyrazinamide Formula: C20H27N5O2 MolecularWeight: 369.46068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCC(=O)NCC1=CC=CC=N1)C(=O)C2=NC=CN=C2

Isomeric SMILES

CCCCCCN(CCC(=O)NCC1=CC=CC=N1)C(=O)C2=NC=CN=C2

InChI

InChI=1S/C20H27N5O2/c1-2-3-4-7-13-25(20(27)18-16-21-11-12-23-18)14-9-19(26)24-15-17-8-5-6-10-22-17/h5-6,8,10-12,16H,2-4,7,9,13-15H2,1H3,(H,24,26)