2-[(2-bromanyl-4,5-dimethoxy-phenyl)methylsulfanyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide

Systemtic Name: 2-[(2-bromanyl-4,5-dimethoxy-phenyl)methylsulfanyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide Openeye Name: 2-[(2-bromo-4,5-dimethoxy-phenyl)methylsulfanyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide CAS Name: 2-[(2-bromo-4,5-dimethoxyphenyl)methylthio]-N-[2-(4-methoxyphenyl)ethyl]propanamide IUPAC Name: 2-[(2-bromo-4,5-dimethoxyphenyl)methylsulfanyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide Traditional Name: 2-[(2-bromo-4,5-dimethoxy-benzyl)thio]-N-[2-(4-methoxyphenyl)ethyl]propionamide Formula: C21H26BrNO4S MolecularWeight: 468.40444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=C(C=C1)OC)SCC2=CC(=C(C=C2Br)OC)OC

Isomeric SMILES

CC(C(=O)NCCC1=CC=C(C=C1)OC)SCC2=CC(=C(C=C2Br)OC)OC

InChI

InChI=1S/C21H26BrNO4S/c1-14(21(24)23-10-9-15-5-7-17(25-2)8-6-15)28-13-16-11-19(26-3)20(27-4)12-18(16)22/h5-8,11-12,14H,9-10,13H2,1-4H3,(H,23,24)