N-(2-methoxyphenyl)-2-[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-(2-methoxyphenyl)-2-[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-quinoline-4-carboxamide Openeye Name: N-(2-methoxyphenyl)-2-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-quinoline-4-carboxamide CAS Name: N-(2-methoxyphenyl)-2-[[2-oxo-2-(1H-pyrrol-2-yl)ethyl]thio]-4-quinolinecarboxamide IUPAC Name: N-(2-methoxyphenyl)-2-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]sulfanylquinoline-4-carboxamide Traditional Name: 2-[[2-keto-2-(1H-pyrrol-2-yl)ethyl]thio]-N-(2-methoxyphenyl)cinchoninamide Formula: C23H19N3O3S MolecularWeight: 417.48026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)C4=CC=CN4

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)C4=CC=CN4

InChI

InChI=1S/C23H19N3O3S/c1-29-21-11-5-4-9-19(21)26-23(28)16-13-22(25-17-8-3-2-7-15(16)17)30-14-20(27)18-10-6-12-24-18/h2-13,24H,14H2,1H3,(H,26,28)