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

Systemtic Name: 3-[6-ethoxycarbonyl-5-methyl-2,4-bis(oxidanylidene)-1H-thieno[2,3-d]pyrimidin-3-yl]propyl-dimethyl-azanium Openeye Name: 3-(6-ethoxycarbonyl-5-methyl-2,4-dioxo-1H-thieno[2,3-d]pyrimidin-3-yl)propyl-dimethyl-ammonium CAS Name: 3-(6-ethoxycarbonyl-5-methyl-2,4-dioxo-1H-thieno[2,3-d]pyrimidin-3-yl)propyl-dimethylammonium IUPAC Name: 3-(6-ethoxycarbonyl-5-methyl-2,4-dioxo-1H-thieno[2,3-d]pyrimidin-3-yl)propyl-dimethylazanium Traditional Name: 3-(6-carbethoxy-2,4-diketo-5-methyl-1H-thieno[2,3-d]pyrimidin-3-yl)propyl-dimethyl-ammonium Formula: C15H22N3O4S+ MolecularWeight: 340.41788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)NC(=O)N(C2=O)CCC[NH+](C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)NC(=O)N(C2=O)CCC[NH+](C)C)C

InChI

InChI=1S/C15H21N3O4S/c1-5-22-14(20)11-9(2)10-12(23-11)16-15(21)18(13(10)19)8-6-7-17(3)4/h5-8H2,1-4H3,(H,16,21)/p+1