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

Systemtic Name: 5-(4-chlorophenyl)-N-[2-oxidanylidene-2-(propylamino)ethyl]-2-phenyl-pyrazole-3-carboxamide Openeye Name: 5-(4-chlorophenyl)-N-[2-oxo-2-(propylamino)ethyl]-2-phenyl-pyrazole-3-carboxamide CAS Name: 5-(4-chlorophenyl)-N-[2-oxo-2-(propylamino)ethyl]-2-phenyl-3-pyrazolecarboxamide IUPAC Name: 5-(4-chlorophenyl)-N-[2-oxo-2-(propylamino)ethyl]-2-phenylpyrazole-3-carboxamide Traditional Name: 5-(4-chlorophenyl)-N-[2-keto-2-(propylamino)ethyl]-2-phenyl-pyrazole-3-carboxamide Formula: C21H21ClN4O2 MolecularWeight: 396.87004

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CNC(=O)C1=CC(=NN1C2=CC=CC=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCNC(=O)CNC(=O)C1=CC(=NN1C2=CC=CC=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H21ClN4O2/c1-2-12-23-20(27)14-24-21(28)19-13-18(15-8-10-16(22)11-9-15)25-26(19)17-6-4-3-5-7-17/h3-11,13H,2,12,14H2,1H3,(H,23,27)(H,24,28)