3-acetamido-N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-benzamide

Systemtic Name: 3-acetamido-N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-benzamide Openeye Name: 3-acetamido-N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-benzamide CAS Name: 3-acetamido-N-[[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]methyl]-N-methylbenzamide IUPAC Name: 3-acetamido-N-[[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methyl]-N-methylbenzamide Traditional Name: 3-acetamido-N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-benzamide Formula: C26H23ClN4O2 MolecularWeight: 458.93942

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C(=O)N(C)CC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C(=O)N(C)CC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C26H23ClN4O2/c1-18(32)28-23-8-6-7-20(15-23)26(33)30(2)16-21-17-31(24-9-4-3-5-10-24)29-25(21)19-11-13-22(27)14-12-19/h3-15,17H,16H2,1-2H3,(H,28,32)