5-methyl-N-(3-methylbutyl)-N-[3-oxidanylidene-3-(phenethylamino)propyl]pyrazine-2-carboxamide

Systemtic Name: 5-methyl-N-(3-methylbutyl)-N-[3-oxidanylidene-3-(phenethylamino)propyl]pyrazine-2-carboxamide Openeye Name: N-isopentyl-5-methyl-N-[3-oxo-3-(phenethylamino)propyl]pyrazine-2-carboxamide CAS Name: 5-methyl-N-(3-methylbutyl)-N-[3-oxo-3-(phenethylamino)propyl]-2-pyrazinecarboxamide IUPAC Name: 5-methyl-N-(3-methylbutyl)-N-[3-oxo-3-(phenethylamino)propyl]pyrazine-2-carboxamide Traditional Name: N-isoamyl-N-[3-keto-3-(phenethylamino)propyl]-5-methyl-pyrazinamide Formula: C22H30N4O2 MolecularWeight: 382.4992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)N(CCC(C)C)CCC(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)N(CCC(C)C)CCC(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C22H30N4O2/c1-17(2)10-13-26(22(28)20-16-24-18(3)15-25-20)14-11-21(27)23-12-9-19-7-5-4-6-8-19/h4-8,15-17H,9-14H2,1-3H3,(H,23,27)