N-cyclopropyl-2-[(9-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]quinoline-4-carboxamide

Systemtic Name: N-cyclopropyl-2-[(9-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]quinoline-4-carboxamide Openeye Name: N-cyclopropyl-2-[(9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]quinoline-4-carboxamide CAS Name: N-cyclopropyl-2-[(9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylthio]-4-quinolinecarboxamide IUPAC Name: N-cyclopropyl-2-[(9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]quinoline-4-carboxamide Traditional Name: N-cyclopropyl-2-[(4-keto-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylthio]cinchoninamide Formula: C23H21N4O2S+ MolecularWeight: 417.50344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2NC(=CC(=O)[N+]2=CC=C1)CSC3=NC4=CC=CC=C4C(=C3)C(=O)NC5CC5

Isomeric SMILES

CC1=C2NC(=CC(=O)[N+]2=CC=C1)CSC3=NC4=CC=CC=C4C(=C3)C(=O)NC5CC5

InChI

InChI=1S/C23H20N4O2S/c1-14-5-4-10-27-21(28)11-16(24-22(14)27)13-30-20-12-18(23(29)25-15-8-9-15)17-6-2-3-7-19(17)26-20/h2-7,10-12,15H,8-9,13H2,1H3,(H,25,29)/p+1