N-(2-methoxyphenyl)-2-[2-oxidanylidene-2-[[(2R)-oxolan-2-yl]methylamino]ethyl]sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-(2-methoxyphenyl)-2-[2-oxidanylidene-2-[[(2R)-oxolan-2-yl]methylamino]ethyl]sulfanyl-quinoline-4-carboxamide Openeye Name: N-(2-methoxyphenyl)-2-[2-oxo-2-[[(2R)-tetrahydrofuran-2-yl]methylamino]ethyl]sulfanyl-quinoline-4-carboxamide CAS Name: N-(2-methoxyphenyl)-2-[[2-oxo-2-[[(2R)-2-oxolanyl]methylamino]ethyl]thio]-4-quinolinecarboxamide IUPAC Name: N-(2-methoxyphenyl)-2-[2-oxo-2-[[(2R)-oxolan-2-yl]methylamino]ethyl]sulfanylquinoline-4-carboxamide Traditional Name: 2-[[2-keto-2-[[(2R)-tetrahydrofuran-2-yl]methylamino]ethyl]thio]-N-(2-methoxyphenyl)cinchoninamide Formula: C24H25N3O4S MolecularWeight: 451.538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)NCC4CCCO4

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)NC[C@H]4CCCO4

InChI

InChI=1S/C24H25N3O4S/c1-30-21-11-5-4-10-20(21)27-24(29)18-13-23(26-19-9-3-2-8-17(18)19)32-15-22(28)25-14-16-7-6-12-31-16/h2-5,8-11,13,16H,6-7,12,14-15H2,1H3,(H,25,28)(H,27,29)/t16-/m1/s1