2-[2-(2,6-dimethylmorpholin-4-yl)-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylic acid

Systemtic Name: 2-[2-(2,6-dimethylmorpholin-4-yl)-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylic acid Openeye Name: 2-[2-(2,6-dimethylmorpholin-4-yl)-2-oxo-ethyl]sulfanylpyridine-3-carboxylic acid CAS Name: 2-[[2-(2,6-dimethyl-4-morpholinyl)-2-oxoethyl]thio]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[[2-(2,6-dimethylmorpholino)-2-keto-ethyl]thio]nicotinic acid Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C(=O)CSC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

CC1CN(CC(O1)C)C(=O)CSC2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C14H18N2O4S/c1-9-6-16(7-10(2)20-9)12(17)8-21-13-11(14(18)19)4-3-5-15-13/h3-5,9-10H,6-8H2,1-2H3,(H,18,19)