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

Systemtic Name: 2-(4-chlorophenyl)-N-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]quinoline-4-carboxamide Openeye Name: 2-(4-chlorophenyl)-N-[(1S)-1-methyl-2-oxo-2-(propylamino)ethyl]quinoline-4-carboxamide CAS Name: 2-(4-chlorophenyl)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]-4-quinolinecarboxamide IUPAC Name: 2-(4-chlorophenyl)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]quinoline-4-carboxamide Traditional Name: 2-(4-chlorophenyl)-N-[(1S)-2-keto-1-methyl-2-(propylamino)ethyl]cinchoninamide Formula: C22H22ClN3O2 MolecularWeight: 395.88198

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H22ClN3O2/c1-3-12-24-21(27)14(2)25-22(28)18-13-20(15-8-10-16(23)11-9-15)26-19-7-5-4-6-17(18)19/h4-11,13-14H,3,12H2,1-2H3,(H,24,27)(H,25,28)/t14-/m0/s1