ethyl 2-chloranyl-4-[[2-(phenylmethylsulfanyl)phenyl]carbonylamino]benzoate

Systemtic Name: ethyl 2-chloranyl-4-[[2-(phenylmethylsulfanyl)phenyl]carbonylamino]benzoate Openeye Name: ethyl 4-[(2-benzylsulfanylbenzoyl)amino]-2-chloro-benzoate CAS Name: 2-chloro-4-[[oxo-[2-(phenylmethylthio)phenyl]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-benzylsulfanylbenzoyl)amino]-2-chlorobenzoate Traditional Name: 4-[[2-(benzylthio)benzoyl]amino]-2-chloro-benzoic acid ethyl ester Formula: C23H20ClNO3S MolecularWeight: 425.9278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SCC3=CC=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SCC3=CC=CC=C3)Cl

InChI

InChI=1S/C23H20ClNO3S/c1-2-28-23(27)18-13-12-17(14-20(18)24)25-22(26)19-10-6-7-11-21(19)29-15-16-8-4-3-5-9-16/h3-14H,2,15H2,1H3,(H,25,26)