[ethanethioyl(phenethyl)amino] benzoate

Systemtic Name: [ethanethioyl(phenethyl)amino] benzoate Openeye Name: [ethanethioyl(phenethyl)amino] benzoate CAS Name: benzoic acid [phenethyl(1-sulfanylideneethyl)amino] ester IUPAC Name: [ethanethioyl(phenethyl)amino] benzoate Traditional Name: benzoic acid [phenethyl(thioacetyl)amino] ester Formula: C17H17NO2S MolecularWeight: 299.38738

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)N(CCC1=CC=CC=C1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(=S)N(CCC1=CC=CC=C1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H17NO2S/c1-14(21)18(13-12-15-8-4-2-5-9-15)20-17(19)16-10-6-3-7-11-16/h2-11H,12-13H2,1H3