N-butyl-2-(3-methylphenyl)-5-phenyl-pyrazole-3-carboxamide

Systemtic Name: N-butyl-2-(3-methylphenyl)-5-phenyl-pyrazole-3-carboxamide Openeye Name: N-butyl-2-(m-tolyl)-5-phenyl-pyrazole-3-carboxamide CAS Name: N-butyl-2-(3-methylphenyl)-5-phenyl-3-pyrazolecarboxamide IUPAC Name: N-butyl-2-(3-methylphenyl)-5-phenylpyrazole-3-carboxamide Traditional Name: N-butyl-2-(m-tolyl)-5-phenyl-pyrazole-3-carboxamide Formula: C21H23N3O MolecularWeight: 333.42682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC(=NN1C2=CC=CC(=C2)C)C3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)C1=CC(=NN1C2=CC=CC(=C2)C)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O/c1-3-4-13-22-21(25)20-15-19(17-10-6-5-7-11-17)23-24(20)18-12-8-9-16(2)14-18/h5-12,14-15H,3-4,13H2,1-2H3,(H,22,25)