2-[[(2R)-2-(dimethylcarbamoyl)pyrrolidin-1-ium-1-yl]methyl]thieno[3,2-d]pyrimidin-4-olate

Systemtic Name: 2-[[(2R)-2-(dimethylcarbamoyl)pyrrolidin-1-ium-1-yl]methyl]thieno[3,2-d]pyrimidin-4-olate Openeye Name: 2-[[(2R)-2-(dimethylcarbamoyl)pyrrolidin-1-ium-1-yl]methyl]thieno[3,2-d]pyrimidin-4-olate CAS Name: 2-[[(2R)-2-[dimethylamino(oxo)methyl]-1-pyrrolidin-1-iumyl]methyl]-4-thieno[3,2-d]pyrimidinolate IUPAC Name: 2-[[(2R)-2-(dimethylcarbamoyl)pyrrolidin-1-ium-1-yl]methyl]thieno[3,2-d]pyrimidin-4-olate Traditional Name: 2-[[(2R)-2-(dimethylcarbamoyl)pyrrolidin-1-ium-1-yl]methyl]thieno[3,2-d]pyrimidin-4-olate Formula: C14H18N4O2S MolecularWeight: 306.38332

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1CCC[NH+]1CC2=NC3=C(C(=N2)[O-])SC=C3

Isomeric SMILES

CN(C)C(=O)[C@H]1CCC[NH+]1CC2=NC3=C(C(=N2)[O-])SC=C3

InChI

InChI=1S/C14H18N4O2S/c1-17(2)14(20)10-4-3-6-18(10)8-11-15-9-5-7-21-12(9)13(19)16-11/h5,7,10H,3-4,6,8H2,1-2H3,(H,15,16,19)/t10-/m1/s1