3-[1-(4-methylphenyl)sulfonylhexyl]-1H-indole-5-carbonitrile

Systemtic Name: 3-[1-(4-methylphenyl)sulfonylhexyl]-1H-indole-5-carbonitrile Openeye Name: 3-[1-(p-tolylsulfonyl)hexyl]-1H-indole-5-carbonitrile CAS Name: 3-[1-(4-methylphenyl)sulfonylhexyl]-1H-indole-5-carbonitrile IUPAC Name: 3-[1-(4-methylphenyl)sulfonylhexyl]-1H-indole-5-carbonitrile Traditional Name: 3-(1-tosylhexyl)-1H-indole-5-carbonitrile Formula: C22H24N2O2S MolecularWeight: 380.50316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CNC2=C1C=C(C=C2)C#N)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCCC(C1=CNC2=C1C=C(C=C2)C#N)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H24N2O2S/c1-3-4-5-6-22(27(25,26)18-10-7-16(2)8-11-18)20-15-24-21-12-9-17(14-23)13-19(20)21/h7-13,15,22,24H,3-6H2,1-2H3