1-methylsulfonyl-3-[4-(2-phenylethynyl)phenyl]pyrazole

Systemtic Name: 1-methylsulfonyl-3-[4-(2-phenylethynyl)phenyl]pyrazole Openeye Name: 1-methylsulfonyl-3-[4-(2-phenylethynyl)phenyl]pyrazole CAS Name: 1-methylsulfonyl-3-[4-(2-phenylethynyl)phenyl]pyrazole IUPAC Name: 1-methylsulfonyl-3-[4-(2-phenylethynyl)phenyl]pyrazole Traditional Name: 1-mesyl-3-[4-(2-phenylethynyl)phenyl]pyrazole Formula: C18H14N2O2S MolecularWeight: 322.38096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1C=CC(=N1)C2=CC=C(C=C2)C#CC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)N1C=CC(=N1)C2=CC=C(C=C2)C#CC3=CC=CC=C3

InChI

InChI=1S/C18H14N2O2S/c1-23(21,22)20-14-13-18(19-20)17-11-9-16(10-12-17)8-7-15-5-3-2-4-6-15/h2-6,9-14H,1H3