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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CN1C2=CC=CC=C2C(=C1Br)CCNS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCCCC#CN1C2=CC=CC=C2C(=C1Br)CCNS(=O)(=O)C3=CC=C(C=C3)C

InChI

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