N-(5-bromanylthiophen-2-yl)sulfonyl-N-butyl-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-(5-bromanylthiophen-2-yl)sulfonyl-N-butyl-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[(5-bromo-2-thienyl)sulfonyl]-N-butyl-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[(5-bromo-2-thiophenyl)sulfonyl]-N-butyl-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-(5-bromothiophen-2-yl)sulfonyl-N-butyl-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[(5-bromo-2-thienyl)sulfonyl]-N-butyl-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C16H18BrNO6S3 MolecularWeight: 496.41622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(S(=O)(=O)C1=CC2=C(C=C1)OCCO2)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

CCCCN(S(=O)(=O)C1=CC2=C(C=C1)OCCO2)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C16H18BrNO6S3/c1-2-3-8-18(27(21,22)16-7-6-15(17)25-16)26(19,20)12-4-5-13-14(11-12)24-10-9-23-13/h4-7,11H,2-3,8-10H2,1H3