2-(4,6-dimethylpyrimidin-2-yl)sulfanylethyl-dimethyl-azanium; 4-oxidanyl-4-oxidanylidene-butanoate

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanylethyl-dimethyl-azanium; 4-oxidanyl-4-oxidanylidene-butanoate Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanylethyl-dimethyl-ammonium; 4-hydroxy-4-oxo-butanoate CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]ethyl-dimethylammonium; 4-hydroxy-4-oxobutanoate IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanylethyl-dimethylazanium; 4-hydroxy-4-oxobutanoate Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]ethyl-dimethyl-ammonium; 4-hydroxy-4-keto-butyrate Formula: C14H23N3O4S MolecularWeight: 329.41512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC[NH+](C)C)C.C(CC(=O)[O-])C(=O)O

Isomeric SMILES

CC1=CC(=NC(=N1)SCC[NH+](C)C)C.C(CC(=O)[O-])C(=O)O

InChI

InChI=1S/C10H17N3S.C4H6O4/c1-8-7-9(2)12-10(11-8)14-6-5-13(3)4;5-3(6)1-2-4(7)8/h7H,5-6H2,1-4H3;1-2H2,(H,5,6)(H,7,8)