2-methyl-N-[4-(phenylcarbonyl)phenyl]-5-propyl-pyrazole-3-carboxamide

Systemtic Name: 2-methyl-N-[4-(phenylcarbonyl)phenyl]-5-propyl-pyrazole-3-carboxamide Openeye Name: N-(4-benzoylphenyl)-2-methyl-5-propyl-pyrazole-3-carboxamide CAS Name: N-(4-benzoylphenyl)-2-methyl-5-propyl-3-pyrazolecarboxamide IUPAC Name: N-(4-benzoylphenyl)-2-methyl-5-propylpyrazole-3-carboxamide Traditional Name: N-(4-benzoylphenyl)-2-methyl-5-propyl-pyrazole-3-carboxamide Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1)C(=O)NC2=CC=C(C=C2)C(=O)C3=CC=CC=C3)C

Isomeric SMILES

CCCC1=NN(C(=C1)C(=O)NC2=CC=C(C=C2)C(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C21H21N3O2/c1-3-7-18-14-19(24(2)23-18)21(26)22-17-12-10-16(11-13-17)20(25)15-8-5-4-6-9-15/h4-6,8-14H,3,7H2,1-2H3,(H,22,26)