2-[(5-bromanyl-2-methoxy-phenyl)methylsulfinyl]-N-propyl-ethanamide

Systemtic Name: 2-[(5-bromanyl-2-methoxy-phenyl)methylsulfinyl]-N-propyl-ethanamide Openeye Name: 2-[(5-bromo-2-methoxy-phenyl)methylsulfinyl]-N-propyl-acetamide CAS Name: 2-[(5-bromo-2-methoxyphenyl)methylsulfinyl]-N-propylacetamide IUPAC Name: 2-[(5-bromo-2-methoxyphenyl)methylsulfinyl]-N-propylacetamide Traditional Name: 2-(5-bromo-2-methoxy-benzyl)sulfinyl-N-propyl-acetamide Formula: C13H18BrNO3S MolecularWeight: 348.25592

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CS(=O)CC1=C(C=CC(=C1)Br)OC

Isomeric SMILES

CCCNC(=O)CS(=O)CC1=C(C=CC(=C1)Br)OC

InChI

InChI=1S/C13H18BrNO3S/c1-3-6-15-13(16)9-19(17)8-10-7-11(14)4-5-12(10)18-2/h4-5,7H,3,6,8-9H2,1-2H3,(H,15,16)