3-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-4-methyl-5-(2-methylfuran-3-yl)-1,2,4-triazole

Systemtic Name: 3-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-4-methyl-5-(2-methylfuran-3-yl)-1,2,4-triazole Openeye Name: 3-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-4-methyl-5-(2-methyl-3-furyl)-1,2,4-triazole CAS Name: 3-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-4-methyl-5-(2-methyl-3-furanyl)-1,2,4-triazole IUPAC Name: 3-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-4-methyl-5-(2-methylfuran-3-yl)-1,2,4-triazole Traditional Name: 3-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-4-methyl-5-(2-methyl-3-furyl)-1,2,4-triazole Formula: C17H16ClN3O3S MolecularWeight: 377.84524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C2=NN=C(N2C)SCC3=C4C(=CC(=C3)Cl)COCO4

Isomeric SMILES

CC1=C(C=CO1)C2=NN=C(N2C)SCC3=C4C(=CC(=C3)Cl)COCO4

InChI

InChI=1S/C17H16ClN3O3S/c1-10-14(3-4-23-10)16-19-20-17(21(16)2)25-8-12-6-13(18)5-11-7-22-9-24-15(11)12/h3-6H,7-9H2,1-2H3