5-methyl-1-(4-methylphenyl)-3-(2-methylpropyl)-N-(pyridin-3-ylmethyl)pyrazole-4-carboxamide

Systemtic Name: 5-methyl-1-(4-methylphenyl)-3-(2-methylpropyl)-N-(pyridin-3-ylmethyl)pyrazole-4-carboxamide Openeye Name: 3-isobutyl-5-methyl-1-(p-tolyl)-N-(3-pyridylmethyl)pyrazole-4-carboxamide CAS Name: 5-methyl-1-(4-methylphenyl)-3-(2-methylpropyl)-N-(3-pyridinylmethyl)-4-pyrazolecarboxamide IUPAC Name: 5-methyl-1-(4-methylphenyl)-3-(2-methylpropyl)-N-(pyridin-3-ylmethyl)pyrazole-4-carboxamide Traditional Name: 3-isobutyl-5-methyl-1-(p-tolyl)-N-(3-pyridylmethyl)pyrazole-4-carboxamide Formula: C22H26N4O MolecularWeight: 362.46804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C(=N2)CC(C)C)C(=O)NCC3=CN=CC=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C(=N2)CC(C)C)C(=O)NCC3=CN=CC=C3)C

InChI

InChI=1S/C22H26N4O/c1-15(2)12-20-21(22(27)24-14-18-6-5-11-23-13-18)17(4)26(25-20)19-9-7-16(3)8-10-19/h5-11,13,15H,12,14H2,1-4H3,(H,24,27)