4-cyclohexyl-3-(2-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazole

Systemtic Name: 4-cyclohexyl-3-(2-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazole Openeye Name: 4-cyclohexyl-3-(2-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazole CAS Name: 4-cyclohexyl-3-(2-methoxyphenyl)-5-(methylthio)-1,2,4-triazole IUPAC Name: 4-cyclohexyl-3-(2-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazole Traditional Name: 4-cyclohexyl-3-(2-methoxyphenyl)-5-(methylthio)-1,2,4-triazole Formula: C16H21N3OS MolecularWeight: 303.42244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN=C(N2C3CCCCC3)SC

Isomeric SMILES

COC1=CC=CC=C1C2=NN=C(N2C3CCCCC3)SC

InChI

InChI=1S/C16H21N3OS/c1-20-14-11-7-6-10-13(14)15-17-18-16(21-2)19(15)12-8-4-3-5-9-12/h6-7,10-12H,3-5,8-9H2,1-2H3