4-[1-(3-bicyclo[2.2.1]heptanyl)ethyl]-3-(furan-2-yl)-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 4-[1-(3-bicyclo[2.2.1]heptanyl)ethyl]-3-(furan-2-yl)-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-(2-furyl)-4-(1-norbornan-2-ylethyl)-5-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 4-[1-(3-bicyclo[2.2.1]heptanyl)ethyl]-3-(2-furanyl)-5-[(4-methylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 4-[1-(3-bicyclo[2.2.1]heptanyl)ethyl]-3-(furan-2-yl)-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-(2-furyl)-5-[(4-methylbenzyl)thio]-4-[1-(2-norbornyl)ethyl]-1,2,4-triazole Formula: C23H27N3OS MolecularWeight: 393.54498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(N2C(C)C3CC4CCC3C4)C5=CC=CO5

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(N2C(C)C3CC4CCC3C4)C5=CC=CO5

InChI

InChI=1S/C23H27N3OS/c1-15-5-7-17(8-6-15)14-28-23-25-24-22(21-4-3-11-27-21)26(23)16(2)20-13-18-9-10-19(20)12-18/h3-8,11,16,18-20H,9-10,12-14H2,1-2H3