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

Systemtic Name: 5-methyl-N-(3-methylbutyl)-N-[3-oxidanylidene-3-[(phenylmethyl)amino]propyl]pyrazine-2-carboxamide Openeye Name: N-[3-(benzylamino)-3-oxo-propyl]-N-isopentyl-5-methyl-pyrazine-2-carboxamide CAS Name: 5-methyl-N-(3-methylbutyl)-N-[3-oxo-3-[(phenylmethyl)amino]propyl]-2-pyrazinecarboxamide IUPAC Name: N-[3-(benzylamino)-3-oxopropyl]-5-methyl-N-(3-methylbutyl)pyrazine-2-carboxamide Traditional Name: N-[3-(benzylamino)-3-keto-propyl]-N-isoamyl-5-methyl-pyrazinamide Formula: C21H28N4O2 MolecularWeight: 368.47262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)N(CCC(C)C)CCC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)N(CCC(C)C)CCC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C21H28N4O2/c1-16(2)9-11-25(21(27)19-15-22-17(3)13-23-19)12-10-20(26)24-14-18-7-5-4-6-8-18/h4-8,13,15-16H,9-12,14H2,1-3H3,(H,24,26)