3-(4-chlorophenyl)-N-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(4-chlorophenyl)-N-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(4-chlorophenyl)-N-[(1S)-1-methyl-2-oxo-2-(propylamino)ethyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(4-chlorophenyl)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(4-chlorophenyl)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(4-chlorophenyl)-N-[(1S)-2-keto-1-methyl-2-(propylamino)ethyl]-1-phenyl-pyrazole-4-carboxamide Formula: C22H23ClN4O2 MolecularWeight: 410.89662

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)C1=CN(N=C1C2=CC=C(C=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)C1=CN(N=C1C2=CC=C(C=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C22H23ClN4O2/c1-3-13-24-21(28)15(2)25-22(29)19-14-27(18-7-5-4-6-8-18)26-20(19)16-9-11-17(23)12-10-16/h4-12,14-15H,3,13H2,1-2H3,(H,24,28)(H,25,29)/t15-/m0/s1