2-[2-[ethyl(phenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-[ethyl(phenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid Openeye Name: 2-[2-(N-ethylanilino)-2-oxo-ethyl]sulfanylacetic acid CAS Name: 2-[[2-(N-ethylanilino)-2-oxoethyl]thio]acetic acid IUPAC Name: 2-[2-(N-ethylanilino)-2-oxoethyl]sulfanylacetic acid Traditional Name: 2-[[2-(N-ethylanilino)-2-keto-ethyl]thio]acetic acid Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)CSCC(=O)O

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)CSCC(=O)O

InChI

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