N-(2-methoxyphenyl)-2-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-(2-methoxyphenyl)-2-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]sulfanyl-quinoline-4-carboxamide Openeye Name: N-(2-methoxyphenyl)-2-[2-oxo-2-(2-thienylmethylamino)ethyl]sulfanyl-quinoline-4-carboxamide CAS Name: N-(2-methoxyphenyl)-2-[[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]thio]-4-quinolinecarboxamide IUPAC Name: N-(2-methoxyphenyl)-2-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]sulfanylquinoline-4-carboxamide Traditional Name: 2-[[2-keto-2-(2-thenylamino)ethyl]thio]-N-(2-methoxyphenyl)cinchoninamide Formula: C24H21N3O3S2 MolecularWeight: 463.57184

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)NCC4=CC=CS4

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)NCC4=CC=CS4

InChI

InChI=1S/C24H21N3O3S2/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/h2-13H,14-15H2,1H3,(H,25,28)(H,27,29)