3-(4-chlorophenyl)-1-ethylsulfonyl-5-(phenylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 3-(4-chlorophenyl)-1-ethylsulfonyl-5-(phenylmethylsulfanyl)-1,2,4-triazole Openeye Name: 5-benzylsulfanyl-3-(4-chlorophenyl)-1-ethylsulfonyl-1,2,4-triazole CAS Name: 3-(4-chlorophenyl)-1-ethylsulfonyl-5-(phenylmethylthio)-1,2,4-triazole IUPAC Name: 5-benzylsulfanyl-3-(4-chlorophenyl)-1-ethylsulfonyl-1,2,4-triazole Traditional Name: 5-(benzylthio)-3-(4-chlorophenyl)-1-esyl-1,2,4-triazole Formula: C17H16ClN3O2S2 MolecularWeight: 393.91084

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1C(=NC(=N1)C2=CC=C(C=C2)Cl)SCC3=CC=CC=C3

Isomeric SMILES

CCS(=O)(=O)N1C(=NC(=N1)C2=CC=C(C=C2)Cl)SCC3=CC=CC=C3

InChI

InChI=1S/C17H16ClN3O2S2/c1-2-25(22,23)21-17(24-12-13-6-4-3-5-7-13)19-16(20-21)14-8-10-15(18)11-9-14/h3-11H,2,12H2,1H3