4-cyclohexyl-3-(3,4-dimethoxyphenyl)-5-(2-methylsulfanylethylsulfanyl)-1,2,4-triazole

Systemtic Name: 4-cyclohexyl-3-(3,4-dimethoxyphenyl)-5-(2-methylsulfanylethylsulfanyl)-1,2,4-triazole Openeye Name: 4-cyclohexyl-3-(3,4-dimethoxyphenyl)-5-(2-methylsulfanylethylsulfanyl)-1,2,4-triazole CAS Name: 4-cyclohexyl-3-(3,4-dimethoxyphenyl)-5-[2-(methylthio)ethylthio]-1,2,4-triazole IUPAC Name: 4-cyclohexyl-3-(3,4-dimethoxyphenyl)-5-(2-methylsulfanylethylsulfanyl)-1,2,4-triazole Traditional Name: 4-cyclohexyl-3-(3,4-dimethoxyphenyl)-5-[2-(methylthio)ethylthio]-1,2,4-triazole Formula: C19H27N3O2S2 MolecularWeight: 393.56658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN=C(N2C3CCCCC3)SCCSC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN=C(N2C3CCCCC3)SCCSC)OC

InChI

InChI=1S/C19H27N3O2S2/c1-23-16-10-9-14(13-17(16)24-2)18-20-21-19(26-12-11-25-3)22(18)15-7-5-4-6-8-15/h9-10,13,15H,4-8,11-12H2,1-3H3