3-[(7-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-4-methyl-1,2,4-triazole

Systemtic Name: 3-[(7-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-4-methyl-1,2,4-triazole Openeye Name: 3-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-4-methyl-1,2,4-triazole CAS Name: 3-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-4-methyl-1,2,4-triazole IUPAC Name: 3-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-4-methyl-1,2,4-triazole Traditional Name: 3-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-4-methyl-1,2,4-triazole Formula: C11H10ClN3O2S MolecularWeight: 283.734

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC2=CC3=C(C(=C2)Cl)OCO3

Isomeric SMILES

CN1C=NN=C1SCC2=CC3=C(C(=C2)Cl)OCO3

InChI

InChI=1S/C11H10ClN3O2S/c1-15-5-13-14-11(15)18-4-7-2-8(12)10-9(3-7)16-6-17-10/h2-3,5H,4,6H2,1H3