[azaniumyl-(3-butyl-6-methoxy-2-methyl-quinolin-4-yl)sulfanyl-methyl]azanium

Systemtic Name: [azaniumyl-(3-butyl-6-methoxy-2-methyl-quinolin-4-yl)sulfanyl-methyl]azanium Openeye Name: [azaniumyl-[(3-butyl-6-methoxy-2-methyl-4-quinolyl)sulfanyl]methyl]ammonium CAS Name: [ammonio-[(3-butyl-6-methoxy-2-methyl-4-quinolinyl)thio]methyl]ammonium IUPAC Name: [azaniumyl-(3-butyl-6-methoxy-2-methylquinolin-4-yl)sulfanylmethyl]azanium Traditional Name: [ammonio-[(3-butyl-6-methoxy-2-methyl-4-quinolyl)thio]methyl]ammonium Formula: C16H25N3OS+2 MolecularWeight: 307.4542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(C=CC(=C2)OC)N=C1C)SC([NH3+])[NH3+]

Isomeric SMILES

CCCCC1=C(C2=C(C=CC(=C2)OC)N=C1C)SC([NH3+])[NH3+]

InChI

InChI=1S/C16H23N3OS/c1-4-5-6-12-10(2)19-14-8-7-11(20-3)9-13(14)15(12)21-16(17)18/h7-9,16H,4-6,17-18H2,1-3H3/p+2