[azaniumyl-(6-bromanyl-2-methyl-quinolin-4-yl)sulfanyl-methyl]azanium

Systemtic Name: [azaniumyl-(6-bromanyl-2-methyl-quinolin-4-yl)sulfanyl-methyl]azanium Openeye Name: [azaniumyl-[(6-bromo-2-methyl-4-quinolyl)sulfanyl]methyl]ammonium CAS Name: [ammonio-[(6-bromo-2-methyl-4-quinolinyl)thio]methyl]ammonium IUPAC Name: [azaniumyl-(6-bromo-2-methylquinolin-4-yl)sulfanylmethyl]azanium Traditional Name: [ammonio-[(6-bromo-2-methyl-4-quinolyl)thio]methyl]ammonium Formula: C11H14BrN3S+2 MolecularWeight: 300.21796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)Br)C(=C1)SC([NH3+])[NH3+]

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)Br)C(=C1)SC([NH3+])[NH3+]

InChI

InChI=1S/C11H12BrN3S/c1-6-4-10(16-11(13)14)8-5-7(12)2-3-9(8)15-6/h2-5,11H,13-14H2,1H3/p+2