6-fluoranyl-4-oxidanylidene-1-[1-(phenylsulfinyl)propan-2-yl]-7-piperazin-1-yl-1,8-naphthyridine-3-carboxylic acid

Systemtic Name: 6-fluoranyl-4-oxidanylidene-1-[1-(phenylsulfinyl)propan-2-yl]-7-piperazin-1-yl-1,8-naphthyridine-3-carboxylic acid Openeye Name: 1-[2-(benzenesulfinyl)-1-methyl-ethyl]-6-fluoro-4-oxo-7-piperazin-1-yl-1,8-naphthyridine-3-carboxylic acid CAS Name: 1-[1-(benzenesulfinyl)propan-2-yl]-6-fluoro-4-oxo-7-(1-piperazinyl)-1,8-naphthyridine-3-carboxylic acid IUPAC Name: 1-[1-(benzenesulfinyl)propan-2-yl]-6-fluoro-4-oxo-7-piperazin-1-yl-1,8-naphthyridine-3-carboxylic acid Traditional Name: 1-[2-(benzenesulfinyl)-1-methyl-ethyl]-6-fluoro-4-keto-7-piperazino-1,8-naphthyridine-3-carboxylic acid Formula: C22H23FN4O4S MolecularWeight: 458.505823

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)C1=CC=CC=C1)N2C=C(C(=O)C3=CC(=C(N=C32)N4CCNCC4)F)C(=O)O

Isomeric SMILES

CC(CS(=O)C1=CC=CC=C1)N2C=C(C(=O)C3=CC(=C(N=C32)N4CCNCC4)F)C(=O)O

InChI

InChI=1S/C22H23FN4O4S/c1-14(13-32(31)15-5-3-2-4-6-15)27-12-17(22(29)30)19(28)16-11-18(23)21(25-20(16)27)26-9-7-24-8-10-26/h2-6,11-12,14,24H,7-10,13H2,1H3,(H,29,30)