3-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-5-(2-cyclopentylethyl)-1H-1,2,4-triazole

Systemtic Name: 3-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-5-(2-cyclopentylethyl)-1H-1,2,4-triazole Openeye Name: 3-[(2-chloro-4-fluoro-phenyl)methylsulfanyl]-5-(2-cyclopentylethyl)-1H-1,2,4-triazole CAS Name: 3-[(2-chloro-4-fluorophenyl)methylthio]-5-(2-cyclopentylethyl)-1H-1,2,4-triazole IUPAC Name: 3-[(2-chloro-4-fluorophenyl)methylsulfanyl]-5-(2-cyclopentylethyl)-1H-1,2,4-triazole Traditional Name: 3-[(2-chloro-4-fluoro-benzyl)thio]-5-(2-cyclopentylethyl)-1H-1,2,4-triazole Formula: C16H19ClFN3S MolecularWeight: 339.858563

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC2=NC(=NN2)SCC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

C1CCC(C1)CCC2=NC(=NN2)SCC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C16H19ClFN3S/c17-14-9-13(18)7-6-12(14)10-22-16-19-15(20-21-16)8-5-11-3-1-2-4-11/h6-7,9,11H,1-5,8,10H2,(H,19,20,21)