N-[3-(3,5-dimethylpyrazol-1-yl)-1-phenyl-propyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[3-(3,5-dimethylpyrazol-1-yl)-1-phenyl-propyl]-4-methyl-benzenesulfonamide Openeye Name: N-[3-(3,5-dimethylpyrazol-1-yl)-1-phenyl-propyl]-4-methyl-benzenesulfonamide CAS Name: N-[3-(3,5-dimethyl-1-pyrazolyl)-1-phenylpropyl]-4-methylbenzenesulfonamide IUPAC Name: N-[3-(3,5-dimethylpyrazol-1-yl)-1-phenylpropyl]-4-methylbenzenesulfonamide Traditional Name: N-[3-(3,5-dimethylpyrazol-1-yl)-1-phenyl-propyl]-4-methyl-benzenesulfonamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCN2C(=CC(=N2)C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCN2C(=CC(=N2)C)C)C3=CC=CC=C3

InChI

InChI=1S/C21H25N3O2S/c1-16-9-11-20(12-10-16)27(25,26)23-21(19-7-5-4-6-8-19)13-14-24-18(3)15-17(2)22-24/h4-12,15,21,23H,13-14H2,1-3H3