4-azido-6-(4-methylsulfonylphenyl)-5-phenyl-2-(trifluoromethyl)pyrimidine

Systemtic Name: 4-azido-6-(4-methylsulfonylphenyl)-5-phenyl-2-(trifluoromethyl)pyrimidine Openeye Name: 4-azido-6-(4-methylsulfonylphenyl)-5-phenyl-2-(trifluoromethyl)pyrimidine CAS Name: 4-azido-6-(4-methylsulfonylphenyl)-5-phenyl-2-(trifluoromethyl)pyrimidine IUPAC Name: 4-azido-6-(4-methylsulfonylphenyl)-5-phenyl-2-(trifluoromethyl)pyrimidine Traditional Name: 4-azido-6-(4-mesylphenyl)-5-phenyl-2-(trifluoromethyl)pyrimidine Formula: C18H12F3N5O2S MolecularWeight: 419.38039

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=NC(=N2)C(F)(F)F)N=[N+]=[N-])C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=NC(=N2)C(F)(F)F)N=[N+]=[N-])C3=CC=CC=C3

InChI

InChI=1S/C18H12F3N5O2S/c1-29(27,28)13-9-7-12(8-10-13)15-14(11-5-3-2-4-6-11)16(25-26-22)24-17(23-15)18(19,20)21/h2-10H,1H3