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

Systemtic Name: N-butyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]pyrazine-2-carboxamide Openeye Name: N-butyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxo-propyl]pyrazine-2-carboxamide CAS Name: N-butyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-2-pyrazinecarboxamide IUPAC Name: N-butyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]pyrazine-2-carboxamide Traditional Name: N-butyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-keto-propyl]pyrazinamide Formula: C21H26N4O2 MolecularWeight: 366.45674

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O2/c1-2-3-12-24(21(27)19-15-22-10-11-23-19)14-9-20(26)25-13-8-17-6-4-5-7-18(17)16-25/h4-7,10-11,15H,2-3,8-9,12-14,16H2,1H3