4-cyclohexyl-3-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-(thiophen-2-ylmethyl)-1,2,4-triazole

Systemtic Name: 4-cyclohexyl-3-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-(thiophen-2-ylmethyl)-1,2,4-triazole Openeye Name: 4-cyclohexyl-3-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-(2-thienylmethyl)-1,2,4-triazole CAS Name: 4-cyclohexyl-3-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-5-(thiophen-2-ylmethyl)-1,2,4-triazole IUPAC Name: 4-cyclohexyl-3-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-(thiophen-2-ylmethyl)-1,2,4-triazole Traditional Name: 4-cyclohexyl-3-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-5-(2-thenyl)-1,2,4-triazole Formula: C22H24FN3O2S2 MolecularWeight: 445.573263

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=C2SCC3=C4C(=CC(=C3)F)COCO4)CC5=CC=CS5

Isomeric SMILES

C1CCC(CC1)N2C(=NN=C2SCC3=C4C(=CC(=C3)F)COCO4)CC5=CC=CS5

InChI

InChI=1S/C22H24FN3O2S2/c23-17-9-15-12-27-14-28-21(15)16(10-17)13-30-22-25-24-20(11-19-7-4-8-29-19)26(22)18-5-2-1-3-6-18/h4,7-10,18H,1-3,5-6,11-14H2