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

Systemtic Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-5-methyl-N-phenethyl-pyrazine-2-carboxamide Openeye Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxo-propyl]-5-methyl-N-phenethyl-pyrazine-2-carboxamide CAS Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-5-methyl-N-phenethyl-2-pyrazinecarboxamide IUPAC Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-5-methyl-N-phenethylpyrazine-2-carboxamide Traditional Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-keto-propyl]-5-methyl-N-phenethyl-pyrazinamide Formula: C26H28N4O2 MolecularWeight: 428.52612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)N(CCC2=CC=CC=C2)CCC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)N(CCC2=CC=CC=C2)CCC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C26H28N4O2/c1-20-17-28-24(18-27-20)26(32)29(14-11-21-7-3-2-4-8-21)16-13-25(31)30-15-12-22-9-5-6-10-23(22)19-30/h2-10,17-18H,11-16,19H2,1H3