2-[6-ethoxycarbonyl-5-methyl-2,4-bis(oxidanylidene)-1H-thieno[2,3-d]pyrimidin-3-yl]ethylazanium

Systemtic Name: 2-[6-ethoxycarbonyl-5-methyl-2,4-bis(oxidanylidene)-1H-thieno[2,3-d]pyrimidin-3-yl]ethylazanium Openeye Name: 2-(6-ethoxycarbonyl-5-methyl-2,4-dioxo-1H-thieno[2,3-d]pyrimidin-3-yl)ethylammonium CAS Name: 2-(6-ethoxycarbonyl-5-methyl-2,4-dioxo-1H-thieno[2,3-d]pyrimidin-3-yl)ethylammonium IUPAC Name: 2-(6-ethoxycarbonyl-5-methyl-2,4-dioxo-1H-thieno[2,3-d]pyrimidin-3-yl)ethylazanium Traditional Name: 2-(6-carbethoxy-2,4-diketo-5-methyl-1H-thieno[2,3-d]pyrimidin-3-yl)ethylammonium Formula: C12H16N3O4S+ MolecularWeight: 298.33814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)NC(=O)N(C2=O)CC[NH3+])C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)NC(=O)N(C2=O)CC[NH3+])C

InChI

InChI=1S/C12H15N3O4S/c1-3-19-11(17)8-6(2)7-9(20-8)14-12(18)15(5-4-13)10(7)16/h3-5,13H2,1-2H3,(H,14,18)/p+1