N-[[(4aR,5S)-1-(4-fluorophenyl)-4a-methyl-4,5,6,7-tetrahydrocyclopenta[f]indazol-5-yl]methyl]-N-(cyanomethyl)-3,5-bis(fluoranyl)benzenesulfonamide

Systemtic Name: N-[[(4aR,5S)-1-(4-fluorophenyl)-4a-methyl-4,5,6,7-tetrahydrocyclopenta[f]indazol-5-yl]methyl]-N-(cyanomethyl)-3,5-bis(fluoranyl)benzenesulfonamide Openeye Name: N-[[(4aR,5S)-1-(4-fluorophenyl)-4a-methyl-4,5,6,7-tetrahydrocyclopenta[f]indazol-5-yl]methyl]-N-(cyanomethyl)-3,5-difluoro-benzenesulfonamide CAS Name: N-[[(4aR,5S)-1-(4-fluorophenyl)-4a-methyl-4,5,6,7-tetrahydrocyclopenta[f]indazol-5-yl]methyl]-N-(cyanomethyl)-3,5-difluorobenzenesulfonamide IUPAC Name: N-[[(4aR,5S)-1-(4-fluorophenyl)-4a-methyl-4,5,6,7-tetrahydrocyclopenta[f]indazol-5-yl]methyl]-N-(cyanomethyl)-3,5-difluorobenzenesulfonamide Traditional Name: N-[[(4aR,5S)-1-(4-fluorophenyl)-4a-methyl-4,5,6,7-tetrahydrocyclopent[f]indazol-5-yl]methyl]-N-(cyanomethyl)-3,5-difluoro-benzenesulfonamide Formula: C26H23F3N4O2S MolecularWeight: 512.54663

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3=C(C=C1CCC2CN(CC#N)S(=O)(=O)C4=CC(=CC(=C4)F)F)N(N=C3)C5=CC=C(C=C5)F

Isomeric SMILES

C[C@]12CC3=C(C=C1CC[C@@H]2CN(CC#N)S(=O)(=O)C4=CC(=CC(=C4)F)F)N(N=C3)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H23F3N4O2S/c1-26-14-17-15-31-33(23-6-4-20(27)5-7-23)25(17)10-18(26)2-3-19(26)16-32(9-8-30)36(34,35)24-12-21(28)11-22(29)13-24/h4-7,10-13,15,19H,2-3,9,14,16H2,1H3/t19-,26+/m1/s1