N-[2-(2-bromanyl-1H-indol-3-yl)ethyl]-4-methyl-N-oct-1-ynyl-benzenesulfonamide

Systemtic Name: N-[2-(2-bromanyl-1H-indol-3-yl)ethyl]-4-methyl-N-oct-1-ynyl-benzenesulfonamide Openeye Name: N-[2-(2-bromo-1H-indol-3-yl)ethyl]-4-methyl-N-oct-1-ynyl-benzenesulfonamide CAS Name: N-[2-(2-bromo-1H-indol-3-yl)ethyl]-4-methyl-N-oct-1-ynylbenzenesulfonamide IUPAC Name: N-[2-(2-bromo-1H-indol-3-yl)ethyl]-4-methyl-N-oct-1-ynylbenzenesulfonamide Traditional Name: N-[2-(2-bromo-1H-indol-3-yl)ethyl]-4-methyl-N-oct-1-ynyl-benzenesulfonamide Formula: C25H29BrN2O2S MolecularWeight: 501.47896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CN(CCC1=C(NC2=CC=CC=C21)Br)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCCCC#CN(CCC1=C(NC2=CC=CC=C21)Br)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H29BrN2O2S/c1-3-4-5-6-7-10-18-28(31(29,30)21-15-13-20(2)14-16-21)19-17-23-22-11-8-9-12-24(22)27-25(23)26/h8-9,11-16,27H,3-7,17,19H2,1-2H3