2-[(2S)-1-[(3-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylquinoline-4-carboxamide

Systemtic Name: 2-[(2S)-1-[(3-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylquinoline-4-carboxamide Openeye Name: 2-[(1S)-2-(3-fluoroanilino)-1-methyl-2-oxo-ethyl]sulfanylquinoline-4-carboxamide CAS Name: 2-[[(2S)-1-(3-fluoroanilino)-1-oxopropan-2-yl]thio]-4-quinolinecarboxamide IUPAC Name: 2-[(2S)-1-(3-fluoroanilino)-1-oxopropan-2-yl]sulfanylquinoline-4-carboxamide Traditional Name: 2-[[(1S)-2-(3-fluoroanilino)-2-keto-1-methyl-ethyl]thio]cinchoninamide Formula: C19H16FN3O2S MolecularWeight: 369.412643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)F)SC2=NC3=CC=CC=C3C(=C2)C(=O)N

Isomeric SMILES

C[C@@H](C(=O)NC1=CC(=CC=C1)F)SC2=NC3=CC=CC=C3C(=C2)C(=O)N

InChI

InChI=1S/C19H16FN3O2S/c1-11(19(25)22-13-6-4-5-12(20)9-13)26-17-10-15(18(21)24)14-7-2-3-8-16(14)23-17/h2-11H,1H3,(H2,21,24)(H,22,25)/t11-/m0/s1