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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(C)C2=NC3=C(C(=C(S3)C)C)C(=O)N2

Isomeric SMILES

CC1CC[NH+](CC1)[C@@H](C)C2=NC3=C(C(=C(S3)C)C)C(=O)N2

InChI

InChI=1S/C16H23N3OS/c1-9-5-7-19(8-6-9)11(3)14-17-15(20)13-10(2)12(4)21-16(13)18-14/h9,11H,5-8H2,1-4H3,(H,17,18,20)/p+1/t11-/m0/s1