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

Systemtic Name: 3-[4-(2-phenylethynyl)phenyl]-1-(phenylsulfonyl)pyrazole Openeye Name: 1-(benzenesulfonyl)-3-[4-(2-phenylethynyl)phenyl]pyrazole CAS Name: 1-(benzenesulfonyl)-3-[4-(2-phenylethynyl)phenyl]pyrazole IUPAC Name: 1-(benzenesulfonyl)-3-[4-(2-phenylethynyl)phenyl]pyrazole Traditional Name: 1-besyl-3-[4-(2-phenylethynyl)phenyl]pyrazole Formula: C23H16N2O2S MolecularWeight: 384.45034

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C3=NN(C=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C3=NN(C=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H16N2O2S/c26-28(27,22-9-5-2-6-10-22)25-18-17-23(24-25)21-15-13-20(14-16-21)12-11-19-7-3-1-4-8-19/h1-10,13-18H