ethyl 3-chloranyl-4-[2-[(4-methoxyphenyl)methylsulfanyl]ethanoylamino]benzoate

Systemtic Name: ethyl 3-chloranyl-4-[2-[(4-methoxyphenyl)methylsulfanyl]ethanoylamino]benzoate Openeye Name: ethyl 3-chloro-4-[[2-[(4-methoxyphenyl)methylsulfanyl]acetyl]amino]benzoate CAS Name: 3-chloro-4-[[2-[(4-methoxyphenyl)methylthio]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-chloro-4-[[2-[(4-methoxyphenyl)methylsulfanyl]acetyl]amino]benzoate Traditional Name: 3-chloro-4-[[2-(p-anisylthio)acetyl]amino]benzoic acid ethyl ester Formula: C19H20ClNO4S MolecularWeight: 393.8844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NC(=O)CSCC2=CC=C(C=C2)OC)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NC(=O)CSCC2=CC=C(C=C2)OC)Cl

InChI

InChI=1S/C19H20ClNO4S/c1-3-25-19(23)14-6-9-17(16(20)10-14)21-18(22)12-26-11-13-4-7-15(24-2)8-5-13/h4-10H,3,11-12H2,1-2H3,(H,21,22)