N-cyclopropyl-2-[2-[(6-fluoranyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-cyclopropyl-2-[2-[(6-fluoranyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-quinoline-4-carboxamide Openeye Name: N-cyclopropyl-2-[2-[(6-fluoro-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl]sulfanyl-quinoline-4-carboxamide CAS Name: N-cyclopropyl-2-[[2-[(6-fluoro-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]thio]-4-quinolinecarboxamide IUPAC Name: N-cyclopropyl-2-[2-[(6-fluoro-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]sulfanylquinoline-4-carboxamide Traditional Name: N-cyclopropyl-2-[[2-[(6-fluoro-1,3-benzothiazol-2-yl)amino]-2-keto-ethyl]thio]cinchoninamide Formula: C22H17FN4O2S2 MolecularWeight: 452.524383

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)NC4=NC5=C(S4)C=C(C=C5)F

Isomeric SMILES

C1CC1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)NC4=NC5=C(S4)C=C(C=C5)F

InChI

InChI=1S/C22H17FN4O2S2/c23-12-5-8-17-18(9-12)31-22(26-17)27-19(28)11-30-20-10-15(21(29)24-13-6-7-13)14-3-1-2-4-16(14)25-20/h1-5,8-10,13H,6-7,11H2,(H,24,29)(H,26,27,28)