[azaniumyl-(3-ethyl-2,6-dimethyl-quinolin-4-yl)sulfanyl-methyl]azanium

Systemtic Name: [azaniumyl-(3-ethyl-2,6-dimethyl-quinolin-4-yl)sulfanyl-methyl]azanium Openeye Name: [azaniumyl-[(3-ethyl-2,6-dimethyl-4-quinolyl)sulfanyl]methyl]ammonium CAS Name: [ammonio-[(3-ethyl-2,6-dimethyl-4-quinolinyl)thio]methyl]ammonium IUPAC Name: [azaniumyl-(3-ethyl-2,6-dimethylquinolin-4-yl)sulfanylmethyl]azanium Traditional Name: [ammonio-[(3-ethyl-2,6-dimethyl-4-quinolyl)thio]methyl]ammonium Formula: C14H21N3S+2 MolecularWeight: 263.40164

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C=CC(=C2)C)N=C1C)SC([NH3+])[NH3+]

Isomeric SMILES

CCC1=C(C2=C(C=CC(=C2)C)N=C1C)SC([NH3+])[NH3+]

InChI

InChI=1S/C14H19N3S/c1-4-10-9(3)17-12-6-5-8(2)7-11(12)13(10)18-14(15)16/h5-7,14H,4,15-16H2,1-3H3/p+2