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

Systemtic Name: 5-methyl-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-methyl-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-methyl-3-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-methyl-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-methyl-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thieno[2,3-d]pyrimidin-4-one Formula: C16H24N3OS+ MolecularWeight: 306.44626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=C1C(=O)N(C=N2)C3CC([NH2+]C(C3)(C)C)(C)C

Isomeric SMILES

CC1=CSC2=C1C(=O)N(C=N2)C3CC([NH2+]C(C3)(C)C)(C)C

InChI

InChI=1S/C16H23N3OS/c1-10-8-21-13-12(10)14(20)19(9-17-13)11-6-15(2,3)18-16(4,5)7-11/h8-9,11,18H,6-7H2,1-5H3/p+1