3-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-4-cyclohexyl-5-methyl-1,2,4-triazole

Systemtic Name: 3-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-4-cyclohexyl-5-methyl-1,2,4-triazole Openeye Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-4-cyclohexyl-5-methyl-1,2,4-triazole CAS Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-4-cyclohexyl-5-methyl-1,2,4-triazole IUPAC Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-4-cyclohexyl-5-methyl-1,2,4-triazole Traditional Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-4-cyclohexyl-5-methyl-1,2,4-triazole Formula: C18H22BrN3O2S MolecularWeight: 424.35518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CCCCC2)SCC3=CC4=C(C=C3Br)OCCO4

Isomeric SMILES

CC1=NN=C(N1C2CCCCC2)SCC3=CC4=C(C=C3Br)OCCO4

InChI

InChI=1S/C18H22BrN3O2S/c1-12-20-21-18(22(12)14-5-3-2-4-6-14)25-11-13-9-16-17(10-15(13)19)24-8-7-23-16/h9-10,14H,2-8,11H2,1H3