ethyl 4-(2-sulfanylethanoylamino)benzoate

Systemtic Name: ethyl 4-(2-sulfanylethanoylamino)benzoate Openeye Name: ethyl 4-[(2-sulfanylacetyl)amino]benzoate CAS Name: 4-[(2-mercapto-1-oxoethyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-sulfanylacetyl)amino]benzoate Traditional Name: 4-[(2-mercaptoacetyl)amino]benzoic acid ethyl ester Formula: C11H13NO3S MolecularWeight: 239.29082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CS

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CS

InChI

InChI=1S/C11H13NO3S/c1-2-15-11(14)8-3-5-9(6-4-8)12-10(13)7-16/h3-6,16H,2,7H2,1H3,(H,12,13)