2-[[5-[(2-fluoranylphenoxy)methyl]-4-hexyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzothiazole

Systemtic Name: 2-[[5-[(2-fluoranylphenoxy)methyl]-4-hexyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzothiazole Openeye Name: 2-[[5-[(2-fluorophenoxy)methyl]-4-hexyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzothiazole CAS Name: 2-[[[5-[(2-fluorophenoxy)methyl]-4-hexyl-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzothiazole IUPAC Name: 2-[[5-[(2-fluorophenoxy)methyl]-4-hexyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzothiazole Traditional Name: 2-[[[5-[(2-fluorophenoxy)methyl]-4-hexyl-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzothiazole Formula: C23H25FN4OS2 MolecularWeight: 456.599203

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=NN=C1SCC2=NC3=CC=CC=C3S2)COC4=CC=CC=C4F

Isomeric SMILES

CCCCCCN1C(=NN=C1SCC2=NC3=CC=CC=C3S2)COC4=CC=CC=C4F

InChI

InChI=1S/C23H25FN4OS2/c1-2-3-4-9-14-28-21(15-29-19-12-7-5-10-17(19)24)26-27-23(28)30-16-22-25-18-11-6-8-13-20(18)31-22/h5-8,10-13H,2-4,9,14-16H2,1H3