1-methyl-4-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]sulfanyl-quinolin-2-one

Systemtic Name: 1-methyl-4-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]sulfanyl-quinolin-2-one Openeye Name: 1-methyl-4-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]sulfanyl-quinolin-2-one CAS Name: 1-methyl-4-[[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]thio]-2-quinolinone IUPAC Name: 1-methyl-4-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]sulfanylquinolin-2-one Traditional Name: 4-[[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]thio]-1-methyl-carbostyril Formula: C17H22N3O2S+ MolecularWeight: 332.44048

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CSC2=CC(=O)N(C3=CC=CC=C32)C

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CSC2=CC(=O)N(C3=CC=CC=C32)C

InChI

InChI=1S/C17H21N3O2S/c1-18-7-9-20(10-8-18)17(22)12-23-15-11-16(21)19(2)14-6-4-3-5-13(14)15/h3-6,11H,7-10,12H2,1-2H3/p+1