2-[(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]ethyl-dimethyl-azanium

Systemtic Name: 2-[(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]ethyl-dimethyl-azanium Openeye Name: 2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]ethyl-dimethyl-ammonium CAS Name: 2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)thio]ethyl-dimethylammonium IUPAC Name: 2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]ethyl-dimethylazanium Traditional Name: 2-[(4-keto-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-2-yl)thio]ethyl-dimethyl-ammonium Formula: C12H18N3OS2+ MolecularWeight: 284.42082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)SCC[NH+](C)C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)SCC[NH+](C)C)C

InChI

InChI=1S/C12H17N3OS2/c1-7-8(2)18-11-9(7)10(16)13-12(14-11)17-6-5-15(3)4/h5-6H2,1-4H3,(H,13,14,16)/p+1