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

Systemtic Name: 5-(2-methylpropyl)-3-[[3-(3-pyrimidin-5-ylphenyl)pyrazol-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 5-isobutyl-3-[[3-(3-pyrimidin-5-ylphenyl)pyrazol-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 5-(2-methylpropyl)-3-[[3-[3-(5-pyrimidinyl)phenyl]-1-pyrazolyl]methyl]-1,2,4-oxadiazole IUPAC Name: 5-(2-methylpropyl)-3-[[3-(3-pyrimidin-5-ylphenyl)pyrazol-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 5-isobutyl-3-[[3-[3-(5-pyrimidyl)phenyl]pyrazol-1-yl]methyl]-1,2,4-oxadiazole Formula: C20H20N6O MolecularWeight: 360.4124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N6O/c1-14(2)8-20-23-19(25-27-20)12-26-7-6-18(24-26)16-5-3-4-15(9-16)17-10-21-13-22-11-17/h3-7,9-11,13-14H,8,12H2,1-2H3