N-butyl-3-(4-methylphenyl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-butyl-3-(4-methylphenyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-butyl-1-phenyl-3-(p-tolyl)pyrazole-4-carboxamide CAS Name: N-butyl-3-(4-methylphenyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-butyl-3-(4-methylphenyl)-1-phenylpyrazole-4-carboxamide Traditional Name: N-butyl-1-phenyl-3-(p-tolyl)pyrazole-4-carboxamide Formula: C21H23N3O MolecularWeight: 333.42682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CN(N=C1C2=CC=C(C=C2)C)C3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)C1=CN(N=C1C2=CC=C(C=C2)C)C3=CC=CC=C3

InChI

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