4-ethyl-3-[(2-fluorophenyl)methylsulfanyl]-5-(2-phenylcyclopropyl)-1,2,4-triazole

Systemtic Name: 4-ethyl-3-[(2-fluorophenyl)methylsulfanyl]-5-(2-phenylcyclopropyl)-1,2,4-triazole Openeye Name: 4-ethyl-3-[(2-fluorophenyl)methylsulfanyl]-5-(2-phenylcyclopropyl)-1,2,4-triazole CAS Name: 4-ethyl-3-[(2-fluorophenyl)methylthio]-5-(2-phenylcyclopropyl)-1,2,4-triazole IUPAC Name: 4-ethyl-3-[(2-fluorophenyl)methylsulfanyl]-5-(2-phenylcyclopropyl)-1,2,4-triazole Traditional Name: 4-ethyl-3-[(2-fluorobenzyl)thio]-5-(2-phenylcyclopropyl)-1,2,4-triazole Formula: C20H20FN3S MolecularWeight: 353.456303

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=CC=C2F)C3CC3C4=CC=CC=C4

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=CC=C2F)C3CC3C4=CC=CC=C4

InChI

InChI=1S/C20H20FN3S/c1-2-24-19(17-12-16(17)14-8-4-3-5-9-14)22-23-20(24)25-13-15-10-6-7-11-18(15)21/h3-11,16-17H,2,12-13H2,1H3