[5-[(4-dimethylaminophenyl)diazenyl]-4-methyl-1,3,4-thiadiazolidin-2-ylidene]-dimethyl-azanium; methyl sulfate

Systemtic Name: [5-[(4-dimethylaminophenyl)diazenyl]-4-methyl-1,3,4-thiadiazolidin-2-ylidene]-dimethyl-azanium; methyl sulfate Openeye Name: [5-(4-dimethylaminophenyl)azo-4-methyl-1,3,4-thiadiazolidin-2-ylidene]-dimethyl-ammonium; methyl sulfate CAS Name: [5-(4-dimethylaminophenyl)azo-4-methyl-1,3,4-thiadiazolidin-2-ylidene]-dimethylammonium; methyl sulfate IUPAC Name: [5-[(4-dimethylaminophenyl)diazenyl]-4-methyl-1,3,4-thiadiazolidin-2-ylidene]-dimethylazanium; methyl sulfate Traditional Name: [5-(4-dimethylaminophenyl)azo-4-methyl-1,3,4-thiadiazolidin-2-ylidene]-dimethyl-ammonium; methyl sulfate Formula: C14H24N6O4S2 MolecularWeight: 404.50816

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(SC(=[N+](C)C)N1)N=NC2=CC=C(C=C2)N(C)C.COS(=O)(=O)[O-]

Isomeric SMILES

CN1C(SC(=[N+](C)C)N1)N=NC2=CC=C(C=C2)N(C)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C13H20N6S.CH4O4S/c1-17(2)11-8-6-10(7-9-11)14-15-12-19(5)16-13(20-12)18(3)4;1-5-6(2,3)4/h6-9,12H,1-5H3;1H3,(H,2,3,4)