N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-2,4,6-trimethyl-benzenesulfonamide

Systemtic Name: N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-2,4,6-trimethyl-benzenesulfonamide Openeye Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-2,4,6-trimethyl-benzenesulfonamide CAS Name: N-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-2,4,6-trimethylbenzenesulfonamide IUPAC Name: N-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]-2,4,6-trimethylbenzenesulfonamide Traditional Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-2,4,6-trimethyl-benzenesulfonamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)NCC2=C(N(N=C2C)CC3=CC=CC=C3)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)NCC2=C(N(N=C2C)CC3=CC=CC=C3)C)C

InChI

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