N-(1,3-benzodioxol-5-yl)-5-bromanyl-N-(pyridin-3-ylmethyl)thiophene-2-sulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-5-bromanyl-N-(pyridin-3-ylmethyl)thiophene-2-sulfonamide Openeye Name: N-(1,3-benzodioxol-5-yl)-5-bromo-N-(3-pyridylmethyl)thiophene-2-sulfonamide CAS Name: N-(1,3-benzodioxol-5-yl)-5-bromo-N-(3-pyridinylmethyl)-2-thiophenesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-5-bromo-N-(pyridin-3-ylmethyl)thiophene-2-sulfonamide Traditional Name: N-(1,3-benzodioxol-5-yl)-5-bromo-N-(3-pyridylmethyl)thiophene-2-sulfonamide Formula: C17H13BrN2O4S2 MolecularWeight: 453.33012

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)N(CC3=CN=CC=C3)S(=O)(=O)C4=CC=C(S4)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)N(CC3=CN=CC=C3)S(=O)(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C17H13BrN2O4S2/c18-16-5-6-17(25-16)26(21,22)20(10-12-2-1-7-19-9-12)13-3-4-14-15(8-13)24-11-23-14/h1-9H,10-11H2