1,3-dimethyl-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]-2,4-bis(oxidanylidene)pyrimidine-5-sulfonamide

Systemtic Name: 1,3-dimethyl-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]-2,4-bis(oxidanylidene)pyrimidine-5-sulfonamide Openeye Name: 1,3-dimethyl-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]-2,4-dioxo-pyrimidine-5-sulfonamide CAS Name: 1,3-dimethyl-N-[(2R)-2-(4-methyl-1-piperidin-1-iumyl)-2-thiophen-2-ylethyl]-2,4-dioxo-5-pyrimidinesulfonamide IUPAC Name: 1,3-dimethyl-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-ylethyl]-2,4-dioxopyrimidine-5-sulfonamide Traditional Name: 2,4-diketo-1,3-dimethyl-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]pyrimidine-5-sulfonamide Formula: C18H27N4O4S2+ MolecularWeight: 427.56138

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(CNS(=O)(=O)C2=CN(C(=O)N(C2=O)C)C)C3=CC=CS3

Isomeric SMILES

CC1CC[NH+](CC1)[C@H](CNS(=O)(=O)C2=CN(C(=O)N(C2=O)C)C)C3=CC=CS3

InChI

InChI=1S/C18H26N4O4S2/c1-13-6-8-22(9-7-13)14(15-5-4-10-27-15)11-19-28(25,26)16-12-20(2)18(24)21(3)17(16)23/h4-5,10,12-14,19H,6-9,11H2,1-3H3/p+1/t14-/m1/s1