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

Systemtic Name: N-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]-4-propyl-benzenesulfonamide Openeye Name: N-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)-4-propyl-benzenesulfonamide CAS Name: N-[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]-4-propylbenzenesulfonamide IUPAC Name: N-(1-benzyl-3,5-dimethylpyrazol-4-yl)-4-propylbenzenesulfonamide Traditional Name: N-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)-4-propyl-benzenesulfonamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(N(N=C2C)CC3=CC=CC=C3)C

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(N(N=C2C)CC3=CC=CC=C3)C

InChI

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