2-(3-methylphenyl)-N-(2-methylpropyl)-5-(4-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: 2-(3-methylphenyl)-N-(2-methylpropyl)-5-(4-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-isobutyl-2-(m-tolyl)-5-(4-nitrophenyl)pyrazole-3-carboxamide CAS Name: 2-(3-methylphenyl)-N-(2-methylpropyl)-5-(4-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: 2-(3-methylphenyl)-N-(2-methylpropyl)-5-(4-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-isobutyl-2-(m-tolyl)-5-(4-nitrophenyl)pyrazole-3-carboxamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=CC(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)NCC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=CC(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)NCC(C)C

InChI

InChI=1S/C21H22N4O3/c1-14(2)13-22-21(26)20-12-19(16-7-9-17(10-8-16)25(27)28)23-24(20)18-6-4-5-15(3)11-18/h4-12,14H,13H2,1-3H3,(H,22,26)