2-(3-chloranyl-4-fluoranyl-phenyl)sulfanyl-N-[(3,4,5-trimethoxyphenyl)methyl]ethanamide

Systemtic Name: 2-(3-chloranyl-4-fluoranyl-phenyl)sulfanyl-N-[(3,4,5-trimethoxyphenyl)methyl]ethanamide Openeye Name: 2-(3-chloro-4-fluoro-phenyl)sulfanyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide CAS Name: 2-[(3-chloro-4-fluorophenyl)thio]-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide IUPAC Name: 2-(3-chloro-4-fluorophenyl)sulfanyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide Traditional Name: 2-[(3-chloro-4-fluoro-phenyl)thio]-N-(3,4,5-trimethoxybenzyl)acetamide Formula: C18H19ClFNO4S MolecularWeight: 399.864163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC(=O)CSC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC(=O)CSC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C18H19ClFNO4S/c1-23-15-6-11(7-16(24-2)18(15)25-3)9-21-17(22)10-26-12-4-5-14(20)13(19)8-12/h4-8H,9-10H2,1-3H3,(H,21,22)