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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=C1C(=O)N(C=N2)CC3CCC[NH2+]3

Isomeric SMILES

CC1=CSC2=C1C(=O)N(C=N2)C[C@H]3CCC[NH2+]3

InChI

InChI=1S/C12H15N3OS/c1-8-6-17-11-10(8)12(16)15(7-14-11)5-9-3-2-4-13-9/h6-7,9,13H,2-5H2,1H3/p+1/t9-/m1/s1