(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl-methyl-(2-morpholin-4-yl-2-oxidanylidene-ethyl)azanium

Systemtic Name: (2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl-methyl-(2-morpholin-4-yl-2-oxidanylidene-ethyl)azanium Openeye Name: (2-chloro-7-methylsulfanyl-3-quinolyl)methyl-methyl-(2-morpholino-2-oxo-ethyl)ammonium CAS Name: [2-chloro-7-(methylthio)-3-quinolinyl]methyl-methyl-[2-(4-morpholinyl)-2-oxoethyl]ammonium IUPAC Name: (2-chloro-7-methylsulfanylquinolin-3-yl)methyl-methyl-(2-morpholin-4-yl-2-oxoethyl)azanium Traditional Name: [2-chloro-7-(methylthio)-3-quinolyl]methyl-(2-keto-2-morpholino-ethyl)-methyl-ammonium Formula: C18H23ClN3O2S+ MolecularWeight: 380.91212

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(N=C2C=C(C=CC2=C1)SC)Cl)CC(=O)N3CCOCC3

Isomeric SMILES

C[NH+](CC1=C(N=C2C=C(C=CC2=C1)SC)Cl)CC(=O)N3CCOCC3

InChI

InChI=1S/C18H22ClN3O2S/c1-21(12-17(23)22-5-7-24-8-6-22)11-14-9-13-3-4-15(25-2)10-16(13)20-18(14)19/h3-4,9-10H,5-8,11-12H2,1-2H3/p+1