2-[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]-N-(pyridin-3-ylmethyl)pyrimidine-5-carboxamide

Systemtic Name: 2-[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]-N-(pyridin-3-ylmethyl)pyrimidine-5-carboxamide Openeye Name: 2-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-N-(3-pyridylmethyl)pyrimidine-5-carboxamide CAS Name: 2-[3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]phenyl]-N-(3-pyridinylmethyl)-5-pyrimidinecarboxamide IUPAC Name: 2-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-N-(pyridin-3-ylmethyl)pyrimidine-5-carboxamide Traditional Name: 2-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-N-(3-pyridylmethyl)pyrimidine-5-carboxamide Formula: C27H23N5O2 MolecularWeight: 449.50382

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC=CC(=C3)C4=NC=C(C=N4)C(=O)NCC5=CN=CC=C5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC=CC(=C3)C4=NC=C(C=N4)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C27H23N5O2/c33-26(31-15-19-5-4-11-28-14-19)24-16-29-25(30-17-24)21-8-3-9-22(13-21)27(34)32-12-10-20-6-1-2-7-23(20)18-32/h1-9,11,13-14,16-17H,10,12,15,18H2,(H,31,33)