2-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanylbenzoate

Systemtic Name: 2-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanylbenzoate Openeye Name: 2-[2-oxo-2-(phenethylamino)ethyl]sulfanylbenzoate CAS Name: 2-[[2-oxo-2-(phenethylamino)ethyl]thio]benzoate IUPAC Name: 2-[2-oxo-2-(phenethylamino)ethyl]sulfanylbenzoate Traditional Name: 2-[[2-keto-2-(phenethylamino)ethyl]thio]benzoate Formula: C17H16NO3S- MolecularWeight: 314.37884

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CSC2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CSC2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C17H17NO3S/c19-16(18-11-10-13-6-2-1-3-7-13)12-22-15-9-5-4-8-14(15)17(20)21/h1-9H,10-12H2,(H,18,19)(H,20,21)/p-1