N-(4-pentylphenyl)-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-(4-pentylphenyl)-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(4-pentylphenyl)pyrazole-4-carboxamide CAS Name: N-(4-pentylphenyl)-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-(4-pentylphenyl)pyrazole-4-carboxamide Traditional Name: N-(4-amylphenyl)-1-benzyl-pyrazole-4-carboxamide Formula: C22H25N3O MolecularWeight: 347.4534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)NC(=O)C2=CN(N=C2)CC3=CC=CC=C3

Isomeric SMILES

CCCCCC1=CC=C(C=C1)NC(=O)C2=CN(N=C2)CC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O/c1-2-3-5-8-18-11-13-21(14-12-18)24-22(26)20-15-23-25(17-20)16-19-9-6-4-7-10-19/h4,6-7,9-15,17H,2-3,5,8,16H2,1H3,(H,24,26)