2-(4-acetamidophenyl)sulfanyl-N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-methyl-ethanamide

Systemtic Name: 2-(4-acetamidophenyl)sulfanyl-N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-(4-acetamidophenyl)sulfanyl-N-[(5-bromo-2-methoxy-phenyl)methyl]-N-methyl-acetamide CAS Name: 2-[(4-acetamidophenyl)thio]-N-[(5-bromo-2-methoxyphenyl)methyl]-N-methylacetamide IUPAC Name: 2-(4-acetamidophenyl)sulfanyl-N-[(5-bromo-2-methoxyphenyl)methyl]-N-methylacetamide Traditional Name: 2-[(4-acetamidophenyl)thio]-N-(5-bromo-2-methoxy-benzyl)-N-methyl-acetamide Formula: C19H21BrN2O3S MolecularWeight: 437.35064

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SCC(=O)N(C)CC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCC(=O)N(C)CC2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C19H21BrN2O3S/c1-13(23)21-16-5-7-17(8-6-16)26-12-19(24)22(2)11-14-10-15(20)4-9-18(14)25-3/h4-10H,11-12H2,1-3H3,(H,21,23)