2-[(3-bromophenyl)methylsulfanyl]-N-(3,4-dimethoxyphenyl)ethanamide

Systemtic Name: 2-[(3-bromophenyl)methylsulfanyl]-N-(3,4-dimethoxyphenyl)ethanamide Openeye Name: 2-[(3-bromophenyl)methylsulfanyl]-N-(3,4-dimethoxyphenyl)acetamide CAS Name: 2-[(3-bromophenyl)methylthio]-N-(3,4-dimethoxyphenyl)acetamide IUPAC Name: 2-[(3-bromophenyl)methylsulfanyl]-N-(3,4-dimethoxyphenyl)acetamide Traditional Name: 2-[(3-bromobenzyl)thio]-N-(3,4-dimethoxyphenyl)acetamide Formula: C17H18BrNO3S MolecularWeight: 396.29872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CSCC2=CC(=CC=C2)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CSCC2=CC(=CC=C2)Br)OC

InChI

InChI=1S/C17H18BrNO3S/c1-21-15-7-6-14(9-16(15)22-2)19-17(20)11-23-10-12-4-3-5-13(18)8-12/h3-9H,10-11H2,1-2H3,(H,19,20)