2,3,4,5,6-pentamethyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]benzenesulfonamide

Systemtic Name: 2,3,4,5,6-pentamethyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]benzenesulfonamide Openeye Name: 2,3,4,5,6-pentamethyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]benzenesulfonamide CAS Name: 2,3,4,5,6-pentamethyl-N-[[2-(1-pyrazolylmethyl)phenyl]methyl]benzenesulfonamide IUPAC Name: 2,3,4,5,6-pentamethyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]benzenesulfonamide Traditional Name: 2,3,4,5,6-pentamethyl-N-[2-(pyrazol-1-ylmethyl)benzyl]benzenesulfonamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)NCC2=CC=CC=C2CN3C=CC=N3)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)NCC2=CC=CC=C2CN3C=CC=N3)C)C

InChI

InChI=1S/C22H27N3O2S/c1-15-16(2)18(4)22(19(5)17(15)3)28(26,27)24-13-20-9-6-7-10-21(20)14-25-12-8-11-23-25/h6-12,24H,13-14H2,1-5H3