1-methyl-3-[2-oxidanyl-3-[2-(phenylsulfinyl)ethylamino]propoxy]quinolin-2-one

Systemtic Name: 1-methyl-3-[2-oxidanyl-3-[2-(phenylsulfinyl)ethylamino]propoxy]quinolin-2-one Openeye Name: 3-[3-[2-(benzenesulfinyl)ethylamino]-2-hydroxy-propoxy]-1-methyl-quinolin-2-one CAS Name: 3-[3-[2-(benzenesulfinyl)ethylamino]-2-hydroxypropoxy]-1-methyl-2-quinolinone IUPAC Name: 3-[3-[2-(benzenesulfinyl)ethylamino]-2-hydroxypropoxy]-1-methylquinolin-2-one Traditional Name: 3-[3-[2-(benzenesulfinyl)ethylamino]-2-hydroxy-propoxy]-1-methyl-carbostyril Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C=C(C1=O)OCC(CNCCS(=O)C3=CC=CC=C3)O

Isomeric SMILES

CN1C2=CC=CC=C2C=C(C1=O)OCC(CNCCS(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C21H24N2O4S/c1-23-19-10-6-5-7-16(19)13-20(21(23)25)27-15-17(24)14-22-11-12-28(26)18-8-3-2-4-9-18/h2-10,13,17,22,24H,11-12,14-15H2,1H3