methyl 4-[[(2-chloranyl-5-methylsulfanyl-phenyl)carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[(2-chloranyl-5-methylsulfanyl-phenyl)carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[(2-chloro-5-methylsulfanyl-benzoyl)amino]methyl]benzoate CAS Name: 4-[[[[2-chloro-5-(methylthio)phenyl]-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2-chloro-5-methylsulfanylbenzoyl)amino]methyl]benzoate Traditional Name: 4-[[[2-chloro-5-(methylthio)benzoyl]amino]methyl]benzoic acid methyl ester Formula: C17H16ClNO3S MolecularWeight: 349.83184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)SC)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)SC)Cl

InChI

InChI=1S/C17H16ClNO3S/c1-22-17(21)12-5-3-11(4-6-12)10-19-16(20)14-9-13(23-2)7-8-15(14)18/h3-9H,10H2,1-2H3,(H,19,20)