2-[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: 2-[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: 2-[2-(2,5-dimethylanilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(2,5-dimethylanilino)-2-oxoethyl]thio]acetate IUPAC Name: 2-[2-(2,5-dimethylanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(2,5-dimethylanilino)-2-keto-ethyl]thio]acetate Formula: C12H14NO3S- MolecularWeight: 252.30946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CSCC(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CSCC(=O)[O-]

InChI

InChI=1S/C12H15NO3S/c1-8-3-4-9(2)10(5-8)13-11(14)6-17-7-12(15)16/h3-5H,6-7H2,1-2H3,(H,13,14)(H,15,16)/p-1