(E)-2-(4-chlorophenyl)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]ethenesulfonamide

Systemtic Name: (E)-2-(4-chlorophenyl)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]ethenesulfonamide Openeye Name: (E)-2-(4-chlorophenyl)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]ethenesulfonamide CAS Name: (E)-2-(4-chlorophenyl)-N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]ethenesulfonamide IUPAC Name: (E)-2-(4-chlorophenyl)-N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]ethenesulfonamide Traditional Name: (E)-2-(4-chlorophenyl)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]ethenesulfonamide Formula: C20H20ClN3O2S MolecularWeight: 401.9097

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNS(=O)(=O)C=CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNS(=O)(=O)/C=C/C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H20ClN3O2S/c1-15-20(16(2)24(23-15)19-6-4-3-5-7-19)14-22-27(25,26)13-12-17-8-10-18(21)11-9-17/h3-13,22H,14H2,1-2H3/b13-12+