4-[2-[(2-chlorophenyl)methylsulfanyl]ethanoylamino]benzoate

Systemtic Name: 4-[2-[(2-chlorophenyl)methylsulfanyl]ethanoylamino]benzoate Openeye Name: 4-[[2-[(2-chlorophenyl)methylsulfanyl]acetyl]amino]benzoate CAS Name: 4-[[2-[(2-chlorophenyl)methylthio]-1-oxoethyl]amino]benzoate IUPAC Name: 4-[[2-[(2-chlorophenyl)methylsulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(2-chlorobenzyl)thio]acetyl]amino]benzoate Formula: C16H13ClNO3S- MolecularWeight: 334.79732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCC(=O)NC2=CC=C(C=C2)C(=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)CSCC(=O)NC2=CC=C(C=C2)C(=O)[O-])Cl

InChI

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