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

Systemtic Name: 3-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-4-cyclopropyl-5-propan-2-yl-1,2,4-triazole Openeye Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-4-cyclopropyl-5-isopropyl-1,2,4-triazole CAS Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-4-cyclopropyl-5-propan-2-yl-1,2,4-triazole IUPAC Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-4-cyclopropyl-5-propan-2-yl-1,2,4-triazole Traditional Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-4-cyclopropyl-5-isopropyl-1,2,4-triazole Formula: C17H20BrN3O2S MolecularWeight: 410.3286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C2CC2)SCC3=CC4=C(C=C3Br)OCCO4

Isomeric SMILES

CC(C)C1=NN=C(N1C2CC2)SCC3=CC4=C(C=C3Br)OCCO4

InChI

InChI=1S/C17H20BrN3O2S/c1-10(2)16-19-20-17(21(16)12-3-4-12)24-9-11-7-14-15(8-13(11)18)23-6-5-22-14/h7-8,10,12H,3-6,9H2,1-2H3