(4-chloranyl-6-ethoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-2-yl)methyl-dimethyl-azanium

Systemtic Name: (4-chloranyl-6-ethoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-2-yl)methyl-dimethyl-azanium Openeye Name: (4-chloro-6-ethoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-2-yl)methyl-dimethyl-ammonium CAS Name: (4-chloro-6-ethoxycarbonyl-5-methyl-2-thieno[2,3-d]pyrimidinyl)methyl-dimethylammonium IUPAC Name: (4-chloro-6-ethoxycarbonyl-5-methylthieno[2,3-d]pyrimidin-2-yl)methyl-dimethylazanium Traditional Name: (6-carbethoxy-4-chloro-5-methyl-thieno[2,3-d]pyrimidin-2-yl)methyl-dimethyl-ammonium Formula: C13H17ClN3O2S+ MolecularWeight: 314.81098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(N=C2Cl)C[NH+](C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(N=C2Cl)C[NH+](C)C)C

InChI

InChI=1S/C13H16ClN3O2S/c1-5-19-13(18)10-7(2)9-11(14)15-8(6-17(3)4)16-12(9)20-10/h5-6H2,1-4H3/p+1