5-chloranyl-2-methylsulfanyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)pyrimidine-4-carboxamide chloride

Systemtic Name: 5-chloranyl-2-methylsulfanyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)pyrimidine-4-carboxamide chloride Openeye Name: 5-chloro-2-methylsulfanyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)pyrimidine-4-carboxamide chloride CAS Name: 5-chloro-2-(methylthio)-N-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)-4-pyrimidinecarboxamide chloride IUPAC Name: 5-chloro-2-methylsulfanyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)pyrimidine-4-carboxamide chloride Traditional Name: 5-chloro-2-(methylthio)-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)pyrimidine-4-carboxamide chloride Formula: C15H24Cl2N4OS MolecularWeight: 379.34826

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)NC(=O)C2=NC(=NC=C2Cl)SC)C.[Cl-]

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)NC(=O)C2=NC(=NC=C2Cl)SC)C.[Cl-]

InChI

InChI=1S/C15H23ClN4OS.ClH/c1-14(2)6-9(7-15(3,4)20-14)18-12(21)11-10(16)8-17-13(19-11)22-5;/h8-9,20H,6-7H2,1-5H3,(H,18,21);1H