2-[2-[ethyl-(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylic acid

Systemtic Name: 2-[2-[ethyl-(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylic acid Openeye Name: 2-[2-(N-ethyl-3-methyl-anilino)-2-oxo-ethyl]sulfanylpyridine-3-carboxylic acid CAS Name: 2-[[2-(N-ethyl-3-methylanilino)-2-oxoethyl]thio]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-(N-ethyl-3-methylanilino)-2-oxoethyl]sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[[2-(N-ethyl-3-methyl-anilino)-2-keto-ethyl]thio]nicotinic acid Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C)C(=O)CSC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

CCN(C1=CC=CC(=C1)C)C(=O)CSC2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C17H18N2O3S/c1-3-19(13-7-4-6-12(2)10-13)15(20)11-23-16-14(17(21)22)8-5-9-18-16/h4-10H,3,11H2,1-2H3,(H,21,22)