4-(2-phenylethynyl)-5,5-bis(phenylsulfonyl)-3,4-dihydropyrazole

Systemtic Name: 4-(2-phenylethynyl)-5,5-bis(phenylsulfonyl)-3,4-dihydropyrazole Openeye Name: 5,5-bis(benzenesulfonyl)-4-(2-phenylethynyl)-3,4-dihydropyrazole CAS Name: 5,5-bis(benzenesulfonyl)-4-(2-phenylethynyl)-3,4-dihydropyrazole IUPAC Name: 5,5-bis(benzenesulfonyl)-4-(2-phenylethynyl)-3,4-dihydropyrazole Traditional Name: 3,3-dibesyl-4-(2-phenylethynyl)-1-pyrazoline Formula: C23H18N2O4S2 MolecularWeight: 450.53002

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(N=N1)(S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)C#CC4=CC=CC=C4

Isomeric SMILES

C1C(C(N=N1)(S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)C#CC4=CC=CC=C4

InChI

InChI=1S/C23H18N2O4S2/c26-30(27,21-12-6-2-7-13-21)23(31(28,29)22-14-8-3-9-15-22)20(18-24-25-23)17-16-19-10-4-1-5-11-19/h1-15,20H,18H2