3-[[5-[(2-fluoranylphenoxy)methyl]-4-hexyl-1,2,4-triazol-3-yl]sulfanyl]oxolan-2-one

Systemtic Name: 3-[[5-[(2-fluoranylphenoxy)methyl]-4-hexyl-1,2,4-triazol-3-yl]sulfanyl]oxolan-2-one Openeye Name: 3-[[5-[(2-fluorophenoxy)methyl]-4-hexyl-1,2,4-triazol-3-yl]sulfanyl]tetrahydrofuran-2-one CAS Name: 3-[[5-[(2-fluorophenoxy)methyl]-4-hexyl-1,2,4-triazol-3-yl]thio]-2-oxolanone IUPAC Name: 3-[[5-[(2-fluorophenoxy)methyl]-4-hexyl-1,2,4-triazol-3-yl]sulfanyl]oxolan-2-one Traditional Name: 3-[[5-[(2-fluorophenoxy)methyl]-4-hexyl-1,2,4-triazol-3-yl]thio]tetrahydrofuran-2-one Formula: C19H24FN3O3S MolecularWeight: 393.475563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=NN=C1SC2CCOC2=O)COC3=CC=CC=C3F

Isomeric SMILES

CCCCCCN1C(=NN=C1SC2CCOC2=O)COC3=CC=CC=C3F

InChI

InChI=1S/C19H24FN3O3S/c1-2-3-4-7-11-23-17(13-26-15-9-6-5-8-14(15)20)21-22-19(23)27-16-10-12-25-18(16)24/h5-6,8-9,16H,2-4,7,10-13H2,1H3