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

Systemtic Name: N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-4-ethanoyl-benzenesulfonamide Openeye Name: 4-acetyl-N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]benzenesulfonamide CAS Name: 4-acetyl-N-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methyl]benzenesulfonamide IUPAC Name: 4-acetyl-N-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]benzenesulfonamide Traditional Name: 4-acetyl-N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]benzenesulfonamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNS(=O)(=O)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNS(=O)(=O)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H23N3O3S/c1-15-21(16(2)24(23-15)14-18-7-5-4-6-8-18)13-22-28(26,27)20-11-9-19(10-12-20)17(3)25/h4-12,22H,13-14H2,1-3H3