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

Systemtic Name: 2-[2-oxidanylidene-2-[phenyl(propan-2-yl)amino]ethyl]sulfanylethanoic acid Openeye Name: 2-[2-(N-isopropylanilino)-2-oxo-ethyl]sulfanylacetic acid CAS Name: 2-[[2-oxo-2-(N-propan-2-ylanilino)ethyl]thio]acetic acid IUPAC Name: 2-[2-oxo-2-(N-propan-2-ylanilino)ethyl]sulfanylacetic acid Traditional Name: 2-[[2-(N-isopropylanilino)-2-keto-ethyl]thio]acetic acid Formula: C13H17NO3S MolecularWeight: 267.34398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO3S/c1-10(2)14(11-6-4-3-5-7-11)12(15)8-18-9-13(16)17/h3-7,10H,8-9H2,1-2H3,(H,16,17)