azanyl-[8-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2-methyl-5-nitro-quinolin-7-yl]-oxidanylidene-azanium

Systemtic Name: azanyl-[8-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2-methyl-5-nitro-quinolin-7-yl]-oxidanylidene-azanium Openeye Name: amino-[8-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2-methyl-5-nitro-7-quinolyl]-oxo-ammonium CAS Name: amino-[8-[(4,6-dimethyl-2-pyrimidinyl)thio]-2-methyl-5-nitro-7-quinolinyl]-oxoammonium IUPAC Name: amino-[8-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2-methyl-5-nitroquinolin-7-yl]-oxoazanium Traditional Name: amino-[8-[(4,6-dimethylpyrimidin-2-yl)thio]-2-methyl-5-nitro-7-quinolyl]-keto-ammonium Formula: C16H15N6O3S+ MolecularWeight: 371.3937

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC(=C2SC3=NC(=CC(=N3)C)C)[N+](=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC(=C2SC3=NC(=CC(=N3)C)C)[N+](=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H15N6O3S/c1-8-4-5-11-12(22(24)25)7-13(21(17)23)15(14(11)18-8)26-16-19-9(2)6-10(3)20-16/h4-7H,1-3H3,(H2,17,23)/q+1