2-[(2-bromanyl-4,5-dimethoxy-phenyl)methylsulfanyl]-N-(4-phenylbutan-2-yl)ethanamide

Systemtic Name: 2-[(2-bromanyl-4,5-dimethoxy-phenyl)methylsulfanyl]-N-(4-phenylbutan-2-yl)ethanamide Openeye Name: 2-[(2-bromo-4,5-dimethoxy-phenyl)methylsulfanyl]-N-(1-methyl-3-phenyl-propyl)acetamide CAS Name: 2-[(2-bromo-4,5-dimethoxyphenyl)methylthio]-N-(4-phenylbutan-2-yl)acetamide IUPAC Name: 2-[(2-bromo-4,5-dimethoxyphenyl)methylsulfanyl]-N-(4-phenylbutan-2-yl)acetamide Traditional Name: 2-[(2-bromo-4,5-dimethoxy-benzyl)thio]-N-(1-methyl-3-phenyl-propyl)acetamide Formula: C21H26BrNO3S MolecularWeight: 452.40504

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)CSCC2=CC(=C(C=C2Br)OC)OC

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)CSCC2=CC(=C(C=C2Br)OC)OC

InChI

InChI=1S/C21H26BrNO3S/c1-15(9-10-16-7-5-4-6-8-16)23-21(24)14-27-13-17-11-19(25-2)20(26-3)12-18(17)22/h4-8,11-12,15H,9-10,13-14H2,1-3H3,(H,23,24)