3-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-4-ethyl-5-(furan-2-yl)-1,2,4-triazole

Systemtic Name: 3-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-4-ethyl-5-(furan-2-yl)-1,2,4-triazole Openeye Name: 3-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-4-ethyl-5-(2-furyl)-1,2,4-triazole CAS Name: 3-[2-(4-chlorophenyl)sulfonylethylthio]-4-ethyl-5-(2-furanyl)-1,2,4-triazole IUPAC Name: 3-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-4-ethyl-5-(furan-2-yl)-1,2,4-triazole Traditional Name: 3-[2-(4-chlorophenyl)sulfonylethylthio]-4-ethyl-5-(2-furyl)-1,2,4-triazole Formula: C16H16ClN3O3S2 MolecularWeight: 397.89954

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCCS(=O)(=O)C2=CC=C(C=C2)Cl)C3=CC=CO3

Isomeric SMILES

CCN1C(=NN=C1SCCS(=O)(=O)C2=CC=C(C=C2)Cl)C3=CC=CO3

InChI

InChI=1S/C16H16ClN3O3S2/c1-2-20-15(14-4-3-9-23-14)18-19-16(20)24-10-11-25(21,22)13-7-5-12(17)6-8-13/h3-9H,2,10-11H2,1H3