3-[[3-(3-isoquinolin-4-ylphenyl)pyrazol-1-yl]methyl]-5-methyl-1,2,4-oxadiazole

Systemtic Name: 3-[[3-(3-isoquinolin-4-ylphenyl)pyrazol-1-yl]methyl]-5-methyl-1,2,4-oxadiazole Openeye Name: 3-[[3-[3-(4-isoquinolyl)phenyl]pyrazol-1-yl]methyl]-5-methyl-1,2,4-oxadiazole CAS Name: 3-[[3-[3-(4-isoquinolinyl)phenyl]-1-pyrazolyl]methyl]-5-methyl-1,2,4-oxadiazole IUPAC Name: 3-[[3-(3-isoquinolin-4-ylphenyl)pyrazol-1-yl]methyl]-5-methyl-1,2,4-oxadiazole Traditional Name: 3-[[3-[3-(4-isoquinolyl)phenyl]pyrazol-1-yl]methyl]-5-methyl-1,2,4-oxadiazole Formula: C22H17N5O MolecularWeight: 367.40328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NO1)CN2C=CC(=N2)C3=CC=CC(=C3)C4=CN=CC5=CC=CC=C54

Isomeric SMILES

CC1=NC(=NO1)CN2C=CC(=N2)C3=CC=CC(=C3)C4=CN=CC5=CC=CC=C54

InChI

InChI=1S/C22H17N5O/c1-15-24-22(26-28-15)14-27-10-9-21(25-27)17-7-4-6-16(11-17)20-13-23-12-18-5-2-3-8-19(18)20/h2-13H,14H2,1H3