5,6-dimethyl-2-[(2R)-pyrrolidin-1-ium-2-yl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[(2R)-pyrrolidin-1-ium-2-yl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-[(2R)-pyrrolidin-1-ium-2-yl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[(2R)-2-pyrrolidin-1-iumyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-[(2R)-pyrrolidin-1-ium-2-yl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-[(2R)-pyrrolidin-1-ium-2-yl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C12H16N3OS+ MolecularWeight: 250.33994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)C3CCC[NH2+]3)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)[C@H]3CCC[NH2+]3)C

InChI

InChI=1S/C12H15N3OS/c1-6-7(2)17-12-9(6)11(16)14-10(15-12)8-4-3-5-13-8/h8,13H,3-5H2,1-2H3,(H,14,15,16)/p+1/t8-/m1/s1