2-[2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: 2-[2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: 2-[2-(4-ethylanilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(4-ethylanilino)-2-oxoethyl]thio]acetate IUPAC Name: 2-[2-(4-ethylanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(4-ethylanilino)-2-keto-ethyl]thio]acetate Formula: C12H14NO3S- MolecularWeight: 252.30946

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CSCC(=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CSCC(=O)[O-]

InChI

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