potassium 4-oxidanyl-4-oxidanylidene-2-[(3-propyl-2H-1,3-benzothiazol-2-yl)sulfanylmethyl]butanoate

Systemtic Name: potassium 4-oxidanyl-4-oxidanylidene-2-[(3-propyl-2H-1,3-benzothiazol-2-yl)sulfanylmethyl]butanoate Openeye Name: potassium 4-hydroxy-4-oxo-2-[(3-propyl-2H-1,3-benzothiazol-2-yl)sulfanylmethyl]butanoate CAS Name: potassium 4-hydroxy-4-oxo-2-[[(3-propyl-2H-1,3-benzothiazol-2-yl)thio]methyl]butanoate IUPAC Name: potassium 4-hydroxy-4-oxo-2-[(3-propyl-2H-1,3-benzothiazol-2-yl)sulfanylmethyl]butanoate Traditional Name: potassium 4-hydroxy-4-keto-2-[[(3-propyl-2H-1,3-benzothiazol-2-yl)thio]methyl]butyrate Formula: C15H18KNO4S2 MolecularWeight: 379.53602

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(SC2=CC=CC=C21)SCC(CC(=O)O)C(=O)[O-].[K+]

Isomeric SMILES

CCCN1C(SC2=CC=CC=C21)SCC(CC(=O)O)C(=O)[O-].[K+]

InChI

InChI=1S/C15H19NO4S2.K/c1-2-7-16-11-5-3-4-6-12(11)22-15(16)21-9-10(14(19)20)8-13(17)18;/h3-6,10,15H,2,7-9H2,1H3,(H,17,18)(H,19,20);/q;+1/p-1