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

Systemtic Name: 3-[(7-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-4-methyl-5-thiophen-2-yl-1,2,4-triazole Openeye Name: 3-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-4-methyl-5-(2-thienyl)-1,2,4-triazole CAS Name: 3-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-4-methyl-5-thiophen-2-yl-1,2,4-triazole IUPAC Name: 3-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-4-methyl-5-thiophen-2-yl-1,2,4-triazole Traditional Name: 3-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-4-methyl-5-(2-thienyl)-1,2,4-triazole Formula: C15H12ClN3O2S2 MolecularWeight: 365.85768

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC3=C(C(=C2)Cl)OCO3)C4=CC=CS4

Isomeric SMILES

CN1C(=NN=C1SCC2=CC3=C(C(=C2)Cl)OCO3)C4=CC=CS4

InChI

InChI=1S/C15H12ClN3O2S2/c1-19-14(12-3-2-4-22-12)17-18-15(19)23-7-9-5-10(16)13-11(6-9)20-8-21-13/h2-6H,7-8H2,1H3