N-isoquinolin-3-yl-2-(phenylmethyl)pyrazole-3-carboxamide

Systemtic Name: N-isoquinolin-3-yl-2-(phenylmethyl)pyrazole-3-carboxamide Openeye Name: 2-benzyl-N-(3-isoquinolyl)pyrazole-3-carboxamide CAS Name: N-(3-isoquinolinyl)-2-(phenylmethyl)-3-pyrazolecarboxamide IUPAC Name: 2-benzyl-N-isoquinolin-3-ylpyrazole-3-carboxamide Traditional Name: 2-benzyl-N-(3-isoquinolyl)pyrazole-3-carboxamide Formula: C20H16N4O MolecularWeight: 328.36724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=CC=N2)C(=O)NC3=CC4=CC=CC=C4C=N3

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=CC=N2)C(=O)NC3=CC4=CC=CC=C4C=N3

InChI

InChI=1S/C20H16N4O/c25-20(23-19-12-16-8-4-5-9-17(16)13-21-19)18-10-11-22-24(18)14-15-6-2-1-3-7-15/h1-13H,14H2,(H,21,23,25)