N-[[5-(4-chlorophenyl)-1-(4-methylphenyl)pyrazol-3-yl]methyl]-N-methyl-cyclohexanecarboxamide

Systemtic Name: N-[[5-(4-chlorophenyl)-1-(4-methylphenyl)pyrazol-3-yl]methyl]-N-methyl-cyclohexanecarboxamide Openeye Name: N-[[5-(4-chlorophenyl)-1-(p-tolyl)pyrazol-3-yl]methyl]-N-methyl-cyclohexanecarboxamide CAS Name: N-[[5-(4-chlorophenyl)-1-(4-methylphenyl)-3-pyrazolyl]methyl]-N-methylcyclohexanecarboxamide IUPAC Name: N-[[5-(4-chlorophenyl)-1-(4-methylphenyl)pyrazol-3-yl]methyl]-N-methylcyclohexanecarboxamide Traditional Name: N-[[5-(4-chlorophenyl)-1-(p-tolyl)pyrazol-3-yl]methyl]-N-methyl-cyclohexanecarboxamide Formula: C25H28ClN3O MolecularWeight: 421.96232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)CN(C)C(=O)C3CCCCC3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)CN(C)C(=O)C3CCCCC3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H28ClN3O/c1-18-8-14-23(15-9-18)29-24(19-10-12-21(26)13-11-19)16-22(27-29)17-28(2)25(30)20-6-4-3-5-7-20/h8-16,20H,3-7,17H2,1-2H3