2-[3-(3-bromanylphenoxy)-2-oxidanyl-propyl]sulfanyl-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide

Systemtic Name: 2-[3-(3-bromanylphenoxy)-2-oxidanyl-propyl]sulfanyl-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide Openeye Name: 2-[3-(3-bromophenoxy)-2-hydroxy-propyl]sulfanyl-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide CAS Name: 2-[[3-(3-bromophenoxy)-2-hydroxypropyl]thio]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide IUPAC Name: 2-[3-(3-bromophenoxy)-2-hydroxypropyl]sulfanyl-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide Traditional Name: 2-[[3-(3-bromophenoxy)-2-hydroxy-propyl]thio]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide Formula: C18H19BrN2O5S2 MolecularWeight: 487.38786

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC(COC3=CC(=CC=C3)Br)O

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC(COC3=CC(=CC=C3)Br)O

InChI

InChI=1S/C18H19BrN2O5S2/c1-21(2)28(23,24)15-6-7-17-16(9-15)20-18(26-17)27-11-13(22)10-25-14-5-3-4-12(19)8-14/h3-9,13,22H,10-11H2,1-2H3