N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]quinoxaline-2-carboxamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]quinoxaline-2-carboxamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]quinoxaline-2-carboxamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methyl-2-pyrrolyl)ethyl]-2-quinoxalinecarboxamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]quinoxaline-2-carboxamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]quinoxaline-2-carboxamide Formula: C25H25N5O MolecularWeight: 411.4989

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(CNC(=O)C2=NC3=CC=CC=C3N=C2)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CN1C=CC=C1C(CNC(=O)C2=NC3=CC=CC=C3N=C2)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C25H25N5O/c1-29-13-6-11-23(29)24(30-14-12-18-7-2-3-8-19(18)17-30)16-27-25(31)22-15-26-20-9-4-5-10-21(20)28-22/h2-11,13,15,24H,12,14,16-17H2,1H3,(H,27,31)