4-[5-cyano-4-(3-fluoranyl-4-methoxy-phenyl)-1-phenethyl-pyrazol-3-yl]benzenesulfonamide

Systemtic Name: 4-[5-cyano-4-(3-fluoranyl-4-methoxy-phenyl)-1-phenethyl-pyrazol-3-yl]benzenesulfonamide Openeye Name: 4-[5-cyano-4-(3-fluoro-4-methoxy-phenyl)-1-phenethyl-pyrazol-3-yl]benzenesulfonamide CAS Name: 4-[5-cyano-4-(3-fluoro-4-methoxyphenyl)-1-phenethyl-3-pyrazolyl]benzenesulfonamide IUPAC Name: 4-[5-cyano-4-(3-fluoro-4-methoxyphenyl)-1-phenethylpyrazol-3-yl]benzenesulfonamide Traditional Name: 4-[5-cyano-4-(3-fluoro-4-methoxy-phenyl)-1-phenethyl-pyrazol-3-yl]benzenesulfonamide Formula: C25H21FN4O3S MolecularWeight: 476.522643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(N(N=C2C3=CC=C(C=C3)S(=O)(=O)N)CCC4=CC=CC=C4)C#N)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(N(N=C2C3=CC=C(C=C3)S(=O)(=O)N)CCC4=CC=CC=C4)C#N)F

InChI

InChI=1S/C25H21FN4O3S/c1-33-23-12-9-19(15-21(23)26)24-22(16-27)30(14-13-17-5-3-2-4-6-17)29-25(24)18-7-10-20(11-8-18)34(28,31)32/h2-12,15H,13-14H2,1H3,(H2,28,31,32)