N-[2-[2-(1,3-benzoxazol-2-yl)-1H-indol-3-yl]ethyl]-4-pentyl-benzenesulfonamide

Systemtic Name: N-[2-[2-(1,3-benzoxazol-2-yl)-1H-indol-3-yl]ethyl]-4-pentyl-benzenesulfonamide Openeye Name: N-[2-[2-(1,3-benzoxazol-2-yl)-1H-indol-3-yl]ethyl]-4-pentyl-benzenesulfonamide CAS Name: N-[2-[2-(1,3-benzoxazol-2-yl)-1H-indol-3-yl]ethyl]-4-pentylbenzenesulfonamide IUPAC Name: N-[2-[2-(1,3-benzoxazol-2-yl)-1H-indol-3-yl]ethyl]-4-pentylbenzenesulfonamide Traditional Name: 4-amyl-N-[2-[2-(1,3-benzoxazol-2-yl)-1H-indol-3-yl]ethyl]benzenesulfonamide Formula: C28H29N3O3S MolecularWeight: 487.61316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)S(=O)(=O)NCCC2=C(NC3=CC=CC=C32)C4=NC5=CC=CC=C5O4

Isomeric SMILES

CCCCCC1=CC=C(C=C1)S(=O)(=O)NCCC2=C(NC3=CC=CC=C32)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C28H29N3O3S/c1-2-3-4-9-20-14-16-21(17-15-20)35(32,33)29-19-18-23-22-10-5-6-11-24(22)30-27(23)28-31-25-12-7-8-13-26(25)34-28/h5-8,10-17,29-30H,2-4,9,18-19H2,1H3