N-cyclopropyl-2-[2-[[(2R)-4-(2-methylpropyl)morpholin-4-ium-2-yl]methylamino]-2-oxidanylidene-ethyl]sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-cyclopropyl-2-[2-[[(2R)-4-(2-methylpropyl)morpholin-4-ium-2-yl]methylamino]-2-oxidanylidene-ethyl]sulfanyl-quinoline-4-carboxamide Openeye Name: N-cyclopropyl-2-[2-[[(2R)-4-isobutylmorpholin-4-ium-2-yl]methylamino]-2-oxo-ethyl]sulfanyl-quinoline-4-carboxamide CAS Name: N-cyclopropyl-2-[[2-[[(2R)-4-(2-methylpropyl)-2-morpholin-4-iumyl]methylamino]-2-oxoethyl]thio]-4-quinolinecarboxamide IUPAC Name: N-cyclopropyl-2-[2-[[(2R)-4-(2-methylpropyl)morpholin-4-ium-2-yl]methylamino]-2-oxoethyl]sulfanylquinoline-4-carboxamide Traditional Name: N-cyclopropyl-2-[[2-[[(2R)-4-isobutylmorpholin-4-ium-2-yl]methylamino]-2-keto-ethyl]thio]cinchoninamide Formula: C24H33N4O3S+ MolecularWeight: 457.60882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCOC(C1)CNC(=O)CSC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CC4

Isomeric SMILES

CC(C)C[NH+]1CCO[C@@H](C1)CNC(=O)CSC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CC4

InChI

InChI=1S/C24H32N4O3S/c1-16(2)13-28-9-10-31-18(14-28)12-25-22(29)15-32-23-11-20(24(30)26-17-7-8-17)19-5-3-4-6-21(19)27-23/h3-6,11,16-18H,7-10,12-15H2,1-2H3,(H,25,29)(H,26,30)/p+1/t18-/m1/s1