N-[2-(3,4-dichlorophenyl)-5-phenyl-pyrazol-3-yl]-2-(2-methylpropylamino)ethanamide

Systemtic Name: N-[2-(3,4-dichlorophenyl)-5-phenyl-pyrazol-3-yl]-2-(2-methylpropylamino)ethanamide Openeye Name: N-[2-(3,4-dichlorophenyl)-5-phenyl-pyrazol-3-yl]-2-(isobutylamino)acetamide CAS Name: N-[2-(3,4-dichlorophenyl)-5-phenyl-3-pyrazolyl]-2-(2-methylpropylamino)acetamide IUPAC Name: N-[2-(3,4-dichlorophenyl)-5-phenylpyrazol-3-yl]-2-(2-methylpropylamino)acetamide Traditional Name: N-[2-(3,4-dichlorophenyl)-5-phenyl-pyrazol-3-yl]-2-(isobutylamino)acetamide Formula: C21H22Cl2N4O MolecularWeight: 417.33158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNCC(=O)NC1=CC(=NN1C2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=C3

Isomeric SMILES

CC(C)CNCC(=O)NC1=CC(=NN1C2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=C3

InChI

InChI=1S/C21H22Cl2N4O/c1-14(2)12-24-13-21(28)25-20-11-19(15-6-4-3-5-7-15)26-27(20)16-8-9-17(22)18(23)10-16/h3-11,14,24H,12-13H2,1-2H3,(H,25,28)