N-[2-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]pyridine-4-carboxamide

Systemtic Name: N-[2-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]pyridine-4-carboxamide Openeye Name: N-[2-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]pyridine-4-carboxamide CAS Name: N-[2-[[1-(2-pyrimidinyl)-2-pyrrolyl]methyl]-3,4-dihydro-1H-isoquinolin-7-yl]-4-pyridinecarboxamide IUPAC Name: N-[2-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]pyridine-4-carboxamide Traditional Name: N-[2-[[1-(2-pyrimidyl)pyrrol-2-yl]methyl]-3,4-dihydro-1H-isoquinolin-7-yl]isonicotinamide Formula: C24H22N6O MolecularWeight: 410.47108

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NC(=O)C3=CC=NC=C3)CC4=CC=CN4C5=NC=CC=N5

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NC(=O)C3=CC=NC=C3)CC4=CC=CN4C5=NC=CC=N5

InChI

InChI=1S/C24H22N6O/c31-23(19-6-11-25-12-7-19)28-21-5-4-18-8-14-29(16-20(18)15-21)17-22-3-1-13-30(22)24-26-9-2-10-27-24/h1-7,9-13,15H,8,14,16-17H2,(H,28,31)