3-[bis(fluoranyl)methyl]-5-(4-methylsulfonylphenyl)-1,4-diphenyl-pyrazole; N-methylmethanamine

Systemtic Name: 3-[bis(fluoranyl)methyl]-5-(4-methylsulfonylphenyl)-1,4-diphenyl-pyrazole; N-methylmethanamine Openeye Name: 3-(difluoromethyl)-5-(4-methylsulfonylphenyl)-1,4-diphenyl-pyrazole; N-methylmethanamine CAS Name: 3-(difluoromethyl)-5-(4-methylsulfonylphenyl)-1,4-diphenylpyrazole; N-methylmethanamine IUPAC Name: 3-(difluoromethyl)-5-(4-methylsulfonylphenyl)-1,4-diphenylpyrazole; N-methylmethanamine Traditional Name: 3-(difluoromethyl)-5-(4-mesylphenyl)-1,4-diphenyl-pyrazole; dimethylamine Formula: C25H25F2N3O2S MolecularWeight: 469.546706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC.CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=NN2C3=CC=CC=C3)C(F)F)C4=CC=CC=C4

Isomeric SMILES

CNC.CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=NN2C3=CC=CC=C3)C(F)F)C4=CC=CC=C4

InChI

InChI=1S/C23H18F2N2O2S.C2H7N/c1-30(28,29)19-14-12-17(13-15-19)22-20(16-8-4-2-5-9-16)21(23(24)25)26-27(22)18-10-6-3-7-11-18;1-3-2/h2-15,23H,1H3;3H,1-2H3