(2-azanyl-2-oxidanylidene-ethyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate Openeye Name: (2-amino-2-oxo-ethyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate CAS Name: 4-[[(4-chlorophenyl)thio]methyl]benzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate Traditional Name: 4-[[(4-chlorophenyl)thio]methyl]benzoic acid (2-amino-2-keto-ethyl) ester Formula: C16H14ClNO3S MolecularWeight: 335.80526

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=CC=C(C=C2)Cl)C(=O)OCC(=O)N

Isomeric SMILES

C1=CC(=CC=C1CSC2=CC=C(C=C2)Cl)C(=O)OCC(=O)N

InChI

InChI=1S/C16H14ClNO3S/c17-13-5-7-14(8-6-13)22-10-11-1-3-12(4-2-11)16(20)21-9-15(18)19/h1-8H,9-10H2,(H2,18,19)