N-(4-bromanyl-2-methyl-phenyl)-2-[methyl-[2-(phenylmethylsulfanyl)ethanoyl]amino]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[methyl-[2-(phenylmethylsulfanyl)ethanoyl]amino]ethanamide Openeye Name: 2-[(2-benzylsulfanylacetyl)-methyl-amino]-N-(4-bromo-2-methyl-phenyl)acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[methyl-[1-oxo-2-(phenylmethylthio)ethyl]amino]acetamide IUPAC Name: 2-[(2-benzylsulfanylacetyl)-methylamino]-N-(4-bromo-2-methylphenyl)acetamide Traditional Name: 2-[[2-(benzylthio)acetyl]-methyl-amino]-N-(4-bromo-2-methyl-phenyl)acetamide Formula: C19H21BrN2O2S MolecularWeight: 421.35124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)CSCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)CSCC2=CC=CC=C2

InChI

InChI=1S/C19H21BrN2O2S/c1-14-10-16(20)8-9-17(14)21-18(23)11-22(2)19(24)13-25-12-15-6-4-3-5-7-15/h3-10H,11-13H2,1-2H3,(H,21,23)