2-[2-oxidanylidene-2-(1-phenylethylamino)ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-oxidanylidene-2-(1-phenylethylamino)ethyl]sulfanylethanoic acid Openeye Name: 2-[2-oxo-2-(1-phenylethylamino)ethyl]sulfanylacetic acid CAS Name: 2-[[2-oxo-2-(1-phenylethylamino)ethyl]thio]acetic acid IUPAC Name: 2-[2-oxo-2-(1-phenylethylamino)ethyl]sulfanylacetic acid Traditional Name: 2-[[2-keto-2-(1-phenylethylamino)ethyl]thio]acetic acid Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CSCC(=O)O

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)CSCC(=O)O

InChI

InChI=1S/C12H15NO3S/c1-9(10-5-3-2-4-6-10)13-11(14)7-17-8-12(15)16/h2-6,9H,7-8H2,1H3,(H,13,14)(H,15,16)