4-ethyl-3-[(2-fluorophenyl)methylsulfanyl]-5-(3-methoxy-1-methyl-pyrazol-4-yl)-1,2,4-triazole

Systemtic Name: 4-ethyl-3-[(2-fluorophenyl)methylsulfanyl]-5-(3-methoxy-1-methyl-pyrazol-4-yl)-1,2,4-triazole Openeye Name: 4-ethyl-3-[(2-fluorophenyl)methylsulfanyl]-5-(3-methoxy-1-methyl-pyrazol-4-yl)-1,2,4-triazole CAS Name: 4-ethyl-3-[(2-fluorophenyl)methylthio]-5-(3-methoxy-1-methyl-4-pyrazolyl)-1,2,4-triazole IUPAC Name: 4-ethyl-3-[(2-fluorophenyl)methylsulfanyl]-5-(3-methoxy-1-methylpyrazol-4-yl)-1,2,4-triazole Traditional Name: 4-ethyl-3-[(2-fluorobenzyl)thio]-5-(3-methoxy-1-methyl-pyrazol-4-yl)-1,2,4-triazole Formula: C16H18FN5OS MolecularWeight: 347.410423

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=CC=C2F)C3=CN(N=C3OC)C

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=CC=C2F)C3=CN(N=C3OC)C

InChI

InChI=1S/C16H18FN5OS/c1-4-22-14(12-9-21(2)20-15(12)23-3)18-19-16(22)24-10-11-7-5-6-8-13(11)17/h5-9H,4,10H2,1-3H3