4-(3-chloranyl-4-methoxy-phenyl)-5-ethyl-2-(trichloromethylsulfanyl)-1,2,4-triazolidin-3-one

Systemtic Name: 4-(3-chloranyl-4-methoxy-phenyl)-5-ethyl-2-(trichloromethylsulfanyl)-1,2,4-triazolidin-3-one Openeye Name: 4-(3-chloro-4-methoxy-phenyl)-5-ethyl-2-(trichloromethylsulfanyl)-1,2,4-triazolidin-3-one CAS Name: 4-(3-chloro-4-methoxyphenyl)-5-ethyl-2-(trichloromethylthio)-1,2,4-triazolidin-3-one IUPAC Name: 4-(3-chloro-4-methoxyphenyl)-5-ethyl-2-(trichloromethylsulfanyl)-1,2,4-triazolidin-3-one Traditional Name: 4-(3-chloro-4-methoxy-phenyl)-5-ethyl-2-(trichloromethylthio)-1,2,4-triazolidin-3-one Formula: C12H13Cl4N3O2S MolecularWeight: 405.12752

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Descriptors Computed from Structure

Canonical SMILES:

CCC1NN(C(=O)N1C2=CC(=C(C=C2)OC)Cl)SC(Cl)(Cl)Cl

Isomeric SMILES

CCC1NN(C(=O)N1C2=CC(=C(C=C2)OC)Cl)SC(Cl)(Cl)Cl

InChI

InChI=1S/C12H13Cl4N3O2S/c1-3-10-17-19(22-12(14,15)16)11(20)18(10)7-4-5-9(21-2)8(13)6-7/h4-6,10,17H,3H2,1-2H3