5-bromanyl-2-methoxy-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzenesulfonamide

Systemtic Name: 5-bromanyl-2-methoxy-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzenesulfonamide Openeye Name: 5-bromo-2-methoxy-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzenesulfonamide CAS Name: 5-bromo-2-methoxy-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzenesulfonamide IUPAC Name: 5-bromo-2-methoxy-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzenesulfonamide Traditional Name: 5-bromo-2-methoxy-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzenesulfonamide Formula: C19H14BrNO3S2 MolecularWeight: 448.35336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3

InChI

InChI=1S/C19H14BrNO3S2/c1-24-18-10-8-15(20)13-19(18)26(22,23)21-16-5-2-4-14(12-16)7-9-17-6-3-11-25-17/h2-6,8,10-13,21H,1H3