N-[8-[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]octyl]methanesulfonamide

Systemtic Name: N-[8-[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]octyl]methanesulfonamide Openeye Name: N-[8-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]octyl]methanesulfonamide CAS Name: N-[8-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]octyl]methanesulfonamide IUPAC Name: N-[8-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]octyl]methanesulfonamide Traditional Name: N-[8-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]octyl]methanesulfonamide Formula: C22H29N5O2S MolecularWeight: 427.56296

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCCCCCCCCC1=CC=C(C=C1)C2=CC=CC=C2C3=NNN=N3

Isomeric SMILES

CS(=O)(=O)NCCCCCCCCC1=CC=C(C=C1)C2=CC=CC=C2C3=NNN=N3

InChI

InChI=1S/C22H29N5O2S/c1-30(28,29)23-17-9-5-3-2-4-6-10-18-13-15-19(16-14-18)20-11-7-8-12-21(20)22-24-26-27-25-22/h7-8,11-16,23H,2-6,9-10,17H2,1H3,(H,24,25,26,27)