2-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-[1-phenyl-3-(3-pyridyl)pyrazole-4-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[oxo-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(1-phenyl-3-pyridin-3-ylpyrazole-4-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-[1-phenyl-3-(3-pyridyl)pyrazole-4-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C25H21N5O2 MolecularWeight: 423.46654

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)C(=O)C3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5)C(=O)N

Isomeric SMILES

C1C(N(CC2=CC=CC=C21)C(=O)C3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5)C(=O)N

InChI

InChI=1S/C25H21N5O2/c26-24(31)22-13-17-7-4-5-8-19(17)15-29(22)25(32)21-16-30(20-10-2-1-3-11-20)28-23(21)18-9-6-12-27-14-18/h1-12,14,16,22H,13,15H2,(H2,26,31)