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

Systemtic Name: 5,6-dimethyl-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-3-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5,6-dimethyl-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thieno[2,3-d]pyrimidin-4-one Formula: C17H26N3OS+ MolecularWeight: 320.47284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)C3CC([NH2+]C(C3)(C)C)(C)C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)C3CC([NH2+]C(C3)(C)C)(C)C)C

InChI

InChI=1S/C17H25N3OS/c1-10-11(2)22-14-13(10)15(21)20(9-18-14)12-7-16(3,4)19-17(5,6)8-12/h9,12,19H,7-8H2,1-6H3/p+1