5-(1,3-benzodioxol-5-yl)-3-[[(5-bromanyl-2-methoxy-phenyl)methyl-methyl-amino]methyl]-1,3,4-oxadiazole-2-thione

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-3-[[(5-bromanyl-2-methoxy-phenyl)methyl-methyl-amino]methyl]-1,3,4-oxadiazole-2-thione Openeye Name: 5-(1,3-benzodioxol-5-yl)-3-[[(5-bromo-2-methoxy-phenyl)methyl-methyl-amino]methyl]-1,3,4-oxadiazole-2-thione CAS Name: 5-(1,3-benzodioxol-5-yl)-3-[[(5-bromo-2-methoxyphenyl)methyl-methylamino]methyl]-1,3,4-oxadiazole-2-thione IUPAC Name: 5-(1,3-benzodioxol-5-yl)-3-[[(5-bromo-2-methoxyphenyl)methyl-methylamino]methyl]-1,3,4-oxadiazole-2-thione Traditional Name: 5-(1,3-benzodioxol-5-yl)-3-[[(5-bromo-2-methoxy-benzyl)-methyl-amino]methyl]-1,3,4-oxadiazole-2-thione Formula: C19H18BrN3O4S MolecularWeight: 464.33292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)Br)OC)CN2C(=S)OC(=N2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN(CC1=C(C=CC(=C1)Br)OC)CN2C(=S)OC(=N2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H18BrN3O4S/c1-22(9-13-7-14(20)4-6-15(13)24-2)10-23-19(28)27-18(21-23)12-3-5-16-17(8-12)26-11-25-16/h3-8H,9-11H2,1-2H3