6-(3-bromanylpropoxy)-3-phenylsulfanyl-2,3-dihydro-1-benzothiophene 1,1-dioxide

Systemtic Name: 6-(3-bromanylpropoxy)-3-phenylsulfanyl-2,3-dihydro-1-benzothiophene 1,1-dioxide Openeye Name: 6-(3-bromopropoxy)-3-phenylsulfanyl-2,3-dihydrobenzothiophene 1,1-dioxide CAS Name: 6-(3-bromopropoxy)-3-(phenylthio)-2,3-dihydro-1-benzothiophene 1,1-dioxide IUPAC Name: 6-(3-bromopropoxy)-3-phenylsulfanyl-2,3-dihydro-1-benzothiophene 1,1-dioxide Traditional Name: 6-(3-bromopropoxy)-3-(phenylthio)-2,3-dihydrobenzothiophene 1,1-dioxide Formula: C17H17BrO3S2 MolecularWeight: 413.34908

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(S1(=O)=O)C=C(C=C2)OCCCBr)SC3=CC=CC=C3

Isomeric SMILES

C1C(C2=C(S1(=O)=O)C=C(C=C2)OCCCBr)SC3=CC=CC=C3

InChI

InChI=1S/C17H17BrO3S2/c18-9-4-10-21-13-7-8-15-16(12-23(19,20)17(15)11-13)22-14-5-2-1-3-6-14/h1-3,5-8,11,16H,4,9-10,12H2