8-[methanidyl-[(E)-(1-methanidylpyrazin-2-ylidene)amino]amino]-1-methylidene-3-oxidanidylperoxysulfanyl-quinolin-1-ium-5-one

Systemtic Name: 8-[methanidyl-[(E)-(1-methanidylpyrazin-2-ylidene)amino]amino]-1-methylidene-3-oxidanidylperoxysulfanyl-quinolin-1-ium-5-one Openeye Name: 8-[methanidyl-[(E)-(1-methanidylpyrazin-2-ylidene)amino]amino]-1-methylene-3-oxidoperoxysulfanyl-quinolin-1-ium-5-one CAS Name: 8-[methanidyl-[(E)-(1-methanidyl-2-pyrazinylidene)amino]amino]-1-methylene-5-oxo-3-quinolin-1-iumsulfenic acid oxidooxy ester IUPAC Name: 8-[methanidyl-[(E)-(1-methanidylpyrazin-2-ylidene)amino]amino]-1-methylidene-3-oxidoperoxysulfanylquinolin-1-ium-5-one Traditional Name: 8-[methanidyl-[(E)-(1-methanidylpyrazin-2-ylidene)amino]amino]-1-methylene-3-(oxidoperoxythio)quinolin-1-ium-5-one Formula: C16H13N5O4S-2 MolecularWeight: 371.37052

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Descriptors Computed from Structure

Canonical SMILES:

[CH2-]N1C=CN=CC1=NN([CH2-])C2=C3C(=CC(=C[N+]3=C)SOO[O-])C(=O)C=C2

Isomeric SMILES

[CH2-]N\1C=CN=C/C1=N\N([CH2-])C2=C3C(=CC(=C[N+]3=C)SOO[O-])C(=O)C=C2

InChI

InChI=1S/C16H14N5O4S/c1-19-7-6-17-9-15(19)18-21(3)13-4-5-14(22)12-8-11(26-25-24-23)10-20(2)16(12)13/h4-10,23H,1-3H2/q-1/p-1/b18-15+