2-oxidanylidene-N-[2-(phenylmethylsulfanyl)phenyl]-3,4-dihydro-1H-quinoline-6-sulfonamide

Systemtic Name: 2-oxidanylidene-N-[2-(phenylmethylsulfanyl)phenyl]-3,4-dihydro-1H-quinoline-6-sulfonamide Openeye Name: N-(2-benzylsulfanylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide CAS Name: 2-oxo-N-[2-(phenylmethylthio)phenyl]-3,4-dihydro-1H-quinoline-6-sulfonamide IUPAC Name: N-(2-benzylsulfanylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide Traditional Name: N-[2-(benzylthio)phenyl]-2-keto-3,4-dihydro-1H-quinoline-6-sulfonamide Formula: C22H20N2O3S2 MolecularWeight: 424.5358

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3SCC4=CC=CC=C4

Isomeric SMILES

C1CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3SCC4=CC=CC=C4

InChI

InChI=1S/C22H20N2O3S2/c25-22-13-10-17-14-18(11-12-19(17)23-22)29(26,27)24-20-8-4-5-9-21(20)28-15-16-6-2-1-3-7-16/h1-9,11-12,14,24H,10,13,15H2,(H,23,25)