N-cyclopropyl-2-[2-[(2-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-cyclopropyl-2-[2-[(2-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-quinoline-4-carboxamide Openeye Name: N-cyclopropyl-2-[2-[(2-fluorophenyl)methylamino]-2-oxo-ethyl]sulfanyl-quinoline-4-carboxamide CAS Name: N-cyclopropyl-2-[[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]thio]-4-quinolinecarboxamide IUPAC Name: N-cyclopropyl-2-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]sulfanylquinoline-4-carboxamide Traditional Name: N-cyclopropyl-2-[[2-[(2-fluorobenzyl)amino]-2-keto-ethyl]thio]cinchoninamide Formula: C22H20FN3O2S MolecularWeight: 409.476503

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)NCC4=CC=CC=C4F

Isomeric SMILES

C1CC1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)NCC4=CC=CC=C4F

InChI

InChI=1S/C22H20FN3O2S/c23-18-7-3-1-5-14(18)12-24-20(27)13-29-21-11-17(22(28)25-15-9-10-15)16-6-2-4-8-19(16)26-21/h1-8,11,15H,9-10,12-13H2,(H,24,27)(H,25,28)