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

Systemtic Name: 2,3,5,6-tetramethyl-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]benzenesulfonamide Openeye Name: 2,3,5,6-tetramethyl-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]benzenesulfonamide CAS Name: 2,3,5,6-tetramethyl-N-[[4-(1-pyrazolylmethyl)phenyl]methyl]benzenesulfonamide IUPAC Name: 2,3,5,6-tetramethyl-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]benzenesulfonamide Traditional Name: 2,3,5,6-tetramethyl-N-[4-(pyrazol-1-ylmethyl)benzyl]benzenesulfonamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)NCC2=CC=C(C=C2)CN3C=CC=N3)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)NCC2=CC=C(C=C2)CN3C=CC=N3)C)C

InChI

InChI=1S/C21H25N3O2S/c1-15-12-16(2)18(4)21(17(15)3)27(25,26)23-13-19-6-8-20(9-7-19)14-24-11-5-10-22-24/h5-12,23H,13-14H2,1-4H3