4-methyl-6-methylsulfanyl-N-[[(2R)-oxolan-2-yl]methyl]quinolin-1-ium-2-amine

Systemtic Name: 4-methyl-6-methylsulfanyl-N-[[(2R)-oxolan-2-yl]methyl]quinolin-1-ium-2-amine Openeye Name: 4-methyl-6-methylsulfanyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]quinolin-1-ium-2-amine CAS Name: 4-methyl-6-(methylthio)-N-[[(2R)-2-oxolanyl]methyl]-2-quinolin-1-iumamine IUPAC Name: 4-methyl-6-methylsulfanyl-N-[[(2R)-oxolan-2-yl]methyl]quinolin-1-ium-2-amine Traditional Name: [4-methyl-6-(methylthio)quinolin-1-ium-2-yl]-[[(2R)-tetrahydrofuran-2-yl]methyl]amine Formula: C16H21N2OS+ MolecularWeight: 289.41574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C2=C1C=C(C=C2)SC)NCC3CCCO3

Isomeric SMILES

CC1=CC(=[NH+]C2=C1C=C(C=C2)SC)NC[C@H]3CCCO3

InChI

InChI=1S/C16H20N2OS/c1-11-8-16(17-10-12-4-3-7-19-12)18-15-6-5-13(20-2)9-14(11)15/h5-6,8-9,12H,3-4,7,10H2,1-2H3,(H,17,18)/p+1/t12-/m1/s1