5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)-N-(4-phenylbutan-2-yl)pyrazole-3-carboxamide

Systemtic Name: 5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)-N-(4-phenylbutan-2-yl)pyrazole-3-carboxamide Openeye Name: 5-(3,4-dimethylphenyl)-N-(1-methyl-3-phenyl-propyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide CAS Name: 5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)-N-(4-phenylbutan-2-yl)-3-pyrazolecarboxamide IUPAC Name: 5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)-N-(4-phenylbutan-2-yl)pyrazole-3-carboxamide Traditional Name: 5-(3,4-dimethylphenyl)-N-(1-methyl-3-phenyl-propyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Formula: C28H28N4O3 MolecularWeight: 468.54692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=C2)C(=O)NC(C)CCC3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=C2)C(=O)NC(C)CCC3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C28H28N4O3/c1-19-12-15-23(16-20(19)2)26-18-27(31(30-26)24-10-7-11-25(17-24)32(34)35)28(33)29-21(3)13-14-22-8-5-4-6-9-22/h4-12,15-18,21H,13-14H2,1-3H3,(H,29,33)