3-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-5-(2-cyclohexylethyl)-4-methyl-1,2,4-triazole

Systemtic Name: 3-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-5-(2-cyclohexylethyl)-4-methyl-1,2,4-triazole Openeye Name: 3-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-5-(2-cyclohexylethyl)-4-methyl-1,2,4-triazole CAS Name: 3-[(2-chloro-6-fluorophenyl)methylthio]-5-(2-cyclohexylethyl)-4-methyl-1,2,4-triazole IUPAC Name: 3-[(2-chloro-6-fluorophenyl)methylsulfanyl]-5-(2-cyclohexylethyl)-4-methyl-1,2,4-triazole Traditional Name: 3-[(2-chloro-6-fluoro-benzyl)thio]-5-(2-cyclohexylethyl)-4-methyl-1,2,4-triazole Formula: C18H23ClFN3S MolecularWeight: 367.911723

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=C(C=CC=C2Cl)F)CCC3CCCCC3

Isomeric SMILES

CN1C(=NN=C1SCC2=C(C=CC=C2Cl)F)CCC3CCCCC3

InChI

InChI=1S/C18H23ClFN3S/c1-23-17(11-10-13-6-3-2-4-7-13)21-22-18(23)24-12-14-15(19)8-5-9-16(14)20/h5,8-9,13H,2-4,6-7,10-12H2,1H3