5-(4-chlorophenyl)-4-methyl-1-(4-pentylphenyl)-N-piperidin-1-yl-pyrazole-3-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-4-methyl-1-(4-pentylphenyl)-N-piperidin-1-yl-pyrazole-3-carboxamide Openeye Name: 5-(4-chlorophenyl)-4-methyl-1-(4-pentylphenyl)-N-(1-piperidyl)pyrazole-3-carboxamide CAS Name: 5-(4-chlorophenyl)-4-methyl-1-(4-pentylphenyl)-N-(1-piperidinyl)-3-pyrazolecarboxamide IUPAC Name: 5-(4-chlorophenyl)-4-methyl-1-(4-pentylphenyl)-N-piperidin-1-ylpyrazole-3-carboxamide Traditional Name: 1-(4-amylphenyl)-5-(4-chlorophenyl)-4-methyl-N-piperidino-pyrazole-3-carboxamide Formula: C27H33ClN4O MolecularWeight: 465.03012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)N2C(=C(C(=N2)C(=O)NN3CCCCC3)C)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCCCCC1=CC=C(C=C1)N2C(=C(C(=N2)C(=O)NN3CCCCC3)C)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H33ClN4O/c1-3-4-6-9-21-10-16-24(17-11-21)32-26(22-12-14-23(28)15-13-22)20(2)25(29-32)27(33)30-31-18-7-5-8-19-31/h10-17H,3-9,18-19H2,1-2H3,(H,30,33)