5-(2-cyclopentylethyl)-3-[(2-fluorophenyl)methylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-(2-cyclopentylethyl)-3-[(2-fluorophenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(2-cyclopentylethyl)-3-[(2-fluorophenyl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-(2-cyclopentylethyl)-3-[(2-fluorophenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-(2-cyclopentylethyl)-3-[(2-fluorophenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(2-cyclopentylethyl)-3-[(2-fluorobenzyl)thio]-1H-1,2,4-triazole Formula: C16H20FN3S MolecularWeight: 305.413503

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC2=NC(=NN2)SCC3=CC=CC=C3F

Isomeric SMILES

C1CCC(C1)CCC2=NC(=NN2)SCC3=CC=CC=C3F

InChI

InChI=1S/C16H20FN3S/c17-14-8-4-3-7-13(14)11-21-16-18-15(19-20-16)10-9-12-5-1-2-6-12/h3-4,7-8,12H,1-2,5-6,9-11H2,(H,18,19,20)