2-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanylethanoate

Systemtic Name: 2-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanylethanoate Openeye Name: 2-[2-(benzylamino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-oxo-2-[(phenylmethyl)amino]ethyl]thio]acetate IUPAC Name: 2-[2-(benzylamino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(benzylamino)-2-keto-ethyl]thio]acetate Formula: C11H12NO3S- MolecularWeight: 238.28288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CSCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CSCC(=O)[O-]

InChI

InChI=1S/C11H13NO3S/c13-10(7-16-8-11(14)15)12-6-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,12,13)(H,14,15)/p-1