N-butyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-5-methyl-pyrazine-2-carboxamide

Systemtic Name: N-butyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-5-methyl-pyrazine-2-carboxamide Openeye Name: N-butyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxo-propyl]-5-methyl-pyrazine-2-carboxamide CAS Name: N-butyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-5-methyl-2-pyrazinecarboxamide IUPAC Name: N-butyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-5-methylpyrazine-2-carboxamide Traditional Name: N-butyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-keto-propyl]-5-methyl-pyrazinamide Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCC(=O)N1CCC2=CC=CC=C2C1)C(=O)C3=CN=C(C=N3)C

Isomeric SMILES

CCCCN(CCC(=O)N1CCC2=CC=CC=C2C1)C(=O)C3=CN=C(C=N3)C

InChI

InChI=1S/C22H28N4O2/c1-3-4-11-25(22(28)20-15-23-17(2)14-24-20)13-10-21(27)26-12-9-18-7-5-6-8-19(18)16-26/h5-8,14-15H,3-4,9-13,16H2,1-2H3