N-[(5-bromanyl-2-methoxy-phenyl)methyl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-methyl-ethanamide

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-methyl-ethanamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-methyl-acetamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-methylacetamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-methylacetamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-methyl-acetamide Formula: C19H20BrNO4S MolecularWeight: 438.3354

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)Br)OC)C(=O)CSC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CN(CC1=C(C=CC(=C1)Br)OC)C(=O)CSC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C19H20BrNO4S/c1-21(11-13-9-14(20)3-5-16(13)23-2)19(22)12-26-15-4-6-17-18(10-15)25-8-7-24-17/h3-6,9-10H,7-8,11-12H2,1-2H3