5-(4-fluorophenyl)-N-(3-methylbutan-2-yl)-2-(3-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: 5-(4-fluorophenyl)-N-(3-methylbutan-2-yl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-(1,2-dimethylpropyl)-5-(4-fluorophenyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide CAS Name: 5-(4-fluorophenyl)-N-(3-methylbutan-2-yl)-2-(3-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: 5-(4-fluorophenyl)-N-(3-methylbutan-2-yl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-(1,2-dimethylpropyl)-5-(4-fluorophenyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Formula: C21H21FN4O3 MolecularWeight: 396.414843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC(=O)C1=CC(=NN1C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)C(C)NC(=O)C1=CC(=NN1C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=C(C=C3)F

InChI

InChI=1S/C21H21FN4O3/c1-13(2)14(3)23-21(27)20-12-19(15-7-9-16(22)10-8-15)24-25(20)17-5-4-6-18(11-17)26(28)29/h4-14H,1-3H3,(H,23,27)