3-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-(4-sulfamoylphenyl)propanamide

Systemtic Name: 3-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-(4-sulfamoylphenyl)propanamide Openeye Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-(4-sulfamoylphenyl)propanamide CAS Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-N-(4-sulfamoylphenyl)propanamide IUPAC Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-(4-sulfamoylphenyl)propanamide Traditional Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-N-(4-sulfamoylphenyl)propionamide Formula: C18H19BrN2O5S2 MolecularWeight: 487.38786

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Br)CSCCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Br)CSCCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C18H19BrN2O5S2/c19-15-10-17-16(25-6-7-26-17)9-12(15)11-27-8-5-18(22)21-13-1-3-14(4-2-13)28(20,23)24/h1-4,9-10H,5-8,11H2,(H,21,22)(H2,20,23,24)