N-cyclopropyl-2-[2-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)amino]-2-oxidanylidene-ethyl]sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-cyclopropyl-2-[2-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)amino]-2-oxidanylidene-ethyl]sulfanyl-quinoline-4-carboxamide Openeye Name: N-cyclopropyl-2-[2-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)amino]-2-oxo-ethyl]sulfanyl-quinoline-4-carboxamide CAS Name: N-cyclopropyl-2-[[2-[[2-methyl-2-(4-morpholin-4-iumyl)propyl]amino]-2-oxoethyl]thio]-4-quinolinecarboxamide IUPAC Name: N-cyclopropyl-2-[2-[(2-methyl-2-morpholin-4-ium-4-ylpropyl)amino]-2-oxoethyl]sulfanylquinoline-4-carboxamide Traditional Name: N-cyclopropyl-2-[[2-keto-2-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)amino]ethyl]thio]cinchoninamide Formula: C23H31N4O3S+ MolecularWeight: 443.58224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)CSC1=NC2=CC=CC=C2C(=C1)C(=O)NC3CC3)[NH+]4CCOCC4

Isomeric SMILES

CC(C)(CNC(=O)CSC1=NC2=CC=CC=C2C(=C1)C(=O)NC3CC3)[NH+]4CCOCC4

InChI

InChI=1S/C23H30N4O3S/c1-23(2,27-9-11-30-12-10-27)15-24-20(28)14-31-21-13-18(22(29)25-16-7-8-16)17-5-3-4-6-19(17)26-21/h3-6,13,16H,7-12,14-15H2,1-2H3,(H,24,28)(H,25,29)/p+1