5-(4-chlorophenyl)-N-[2-(2-methylpropanoylamino)ethyl]-2-phenyl-pyrazole-3-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-N-[2-(2-methylpropanoylamino)ethyl]-2-phenyl-pyrazole-3-carboxamide Openeye Name: 5-(4-chlorophenyl)-N-[2-(2-methylpropanoylamino)ethyl]-2-phenyl-pyrazole-3-carboxamide CAS Name: 5-(4-chlorophenyl)-N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-2-phenyl-3-pyrazolecarboxamide IUPAC Name: 5-(4-chlorophenyl)-N-[2-(2-methylpropanoylamino)ethyl]-2-phenylpyrazole-3-carboxamide Traditional Name: 5-(4-chlorophenyl)-N-[2-(isobutyrylamino)ethyl]-2-phenyl-pyrazole-3-carboxamide Formula: C22H23ClN4O2 MolecularWeight: 410.89662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)C1=CC(=NN1C2=CC=CC=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)C1=CC(=NN1C2=CC=CC=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H23ClN4O2/c1-15(2)21(28)24-12-13-25-22(29)20-14-19(16-8-10-17(23)11-9-16)26-27(20)18-6-4-3-5-7-18/h3-11,14-15H,12-13H2,1-2H3,(H,24,28)(H,25,29)