1-(7,7-dimethyl-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl)-N-[[5-[(4-fluorophenyl)methylsulfanyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]methyl]methanesulfonamide

Systemtic Name: 1-(7,7-dimethyl-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl)-N-[[5-[(4-fluorophenyl)methylsulfanyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]methyl]methanesulfonamide Openeye Name: 1-(7,7-dimethyl-2-oxo-norbornan-1-yl)-N-[[5-[(4-fluorophenyl)methylsulfanyl]-4-(p-tolyl)-1,2,4-triazol-3-yl]methyl]methanesulfonamide CAS Name: 1-(7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl)-N-[[5-[(4-fluorophenyl)methylthio]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]methyl]methanesulfonamide IUPAC Name: 1-(7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl)-N-[[5-[(4-fluorophenyl)methylsulfanyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]methyl]methanesulfonamide Traditional Name: N-[[5-[(4-fluorobenzyl)thio]-4-(p-tolyl)-1,2,4-triazol-3-yl]methyl]-1-(2-keto-7,7-dimethyl-norbornan-1-yl)methanesulfonamide Formula: C27H31FN4O3S2 MolecularWeight: 542.688443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)F)CNS(=O)(=O)CC45CCC(C4(C)C)CC5=O

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)F)CNS(=O)(=O)CC45CCC(C4(C)C)CC5=O

InChI

InChI=1S/C27H31FN4O3S2/c1-18-4-10-22(11-5-18)32-24(30-31-25(32)36-16-19-6-8-21(28)9-7-19)15-29-37(34,35)17-27-13-12-20(14-23(27)33)26(27,2)3/h4-11,20,29H,12-17H2,1-3H3