2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[(2S)-2-methyl-1-piperidin-1-iumyl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C13H18N3OS+ MolecularWeight: 264.36652

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC2=NC(=O)C3=C(N2)C=CS3

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC2=NC(=O)C3=C(N2)C=CS3

InChI

InChI=1S/C13H17N3OS/c1-9-4-2-3-6-16(9)8-11-14-10-5-7-18-12(10)13(17)15-11/h5,7,9H,2-4,6,8H2,1H3,(H,14,15,17)/p+1/t9-/m0/s1