N-cyclopropyl-2-[1-oxidanylidene-1-(1-phenylethylamino)propan-2-yl]sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-cyclopropyl-2-[1-oxidanylidene-1-(1-phenylethylamino)propan-2-yl]sulfanyl-quinoline-4-carboxamide Openeye Name: N-cyclopropyl-2-[1-methyl-2-oxo-2-(1-phenylethylamino)ethyl]sulfanyl-quinoline-4-carboxamide CAS Name: N-cyclopropyl-2-[[1-oxo-1-(1-phenylethylamino)propan-2-yl]thio]-4-quinolinecarboxamide IUPAC Name: N-cyclopropyl-2-[1-oxo-1-(1-phenylethylamino)propan-2-yl]sulfanylquinoline-4-carboxamide Traditional Name: N-cyclopropyl-2-[[2-keto-1-methyl-2-(1-phenylethylamino)ethyl]thio]cinchoninamide Formula: C24H25N3O2S MolecularWeight: 419.5392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CC4

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CC4

InChI

InChI=1S/C24H25N3O2S/c1-15(17-8-4-3-5-9-17)25-23(28)16(2)30-22-14-20(24(29)26-18-12-13-18)19-10-6-7-11-21(19)27-22/h3-11,14-16,18H,12-13H2,1-2H3,(H,25,28)(H,26,29)