3-methyl-1-(4-methylsulfonylphenyl)-5-phenyl-pyrazole

Systemtic Name: 3-methyl-1-(4-methylsulfonylphenyl)-5-phenyl-pyrazole Openeye Name: 3-methyl-1-(4-methylsulfonylphenyl)-5-phenyl-pyrazole CAS Name: 3-methyl-1-(4-methylsulfonylphenyl)-5-phenylpyrazole IUPAC Name: 3-methyl-1-(4-methylsulfonylphenyl)-5-phenylpyrazole Traditional Name: 1-(4-mesylphenyl)-3-methyl-5-phenyl-pyrazole Formula: C17H16N2O2S MolecularWeight: 312.38614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=NN(C(=C1)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C17H16N2O2S/c1-13-12-17(14-6-4-3-5-7-14)19(18-13)15-8-10-16(11-9-15)22(2,20)21/h3-12H,1-2H3