N-[(3-cyanophenyl)methyl]-2-(2-methylpropyl)pyrazole-3-carboxamide

Systemtic Name: N-[(3-cyanophenyl)methyl]-2-(2-methylpropyl)pyrazole-3-carboxamide Openeye Name: N-[(3-cyanophenyl)methyl]-2-isobutyl-pyrazole-3-carboxamide CAS Name: N-[(3-cyanophenyl)methyl]-2-(2-methylpropyl)-3-pyrazolecarboxamide IUPAC Name: N-[(3-cyanophenyl)methyl]-2-(2-methylpropyl)pyrazole-3-carboxamide Traditional Name: N-(3-cyanobenzyl)-2-isobutyl-pyrazole-3-carboxamide Formula: C16H18N4O MolecularWeight: 282.34032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CC=N1)C(=O)NCC2=CC=CC(=C2)C#N

Isomeric SMILES

CC(C)CN1C(=CC=N1)C(=O)NCC2=CC=CC(=C2)C#N

InChI

InChI=1S/C16H18N4O/c1-12(2)11-20-15(6-7-19-20)16(21)18-10-14-5-3-4-13(8-14)9-17/h3-8,12H,10-11H2,1-2H3,(H,18,21)