5-(5-chloranyl-2-methoxy-phenyl)-3-(2-ethoxyethylsulfanyl)-1H-1,2,4-triazole

Systemtic Name: 5-(5-chloranyl-2-methoxy-phenyl)-3-(2-ethoxyethylsulfanyl)-1H-1,2,4-triazole Openeye Name: 5-(5-chloro-2-methoxy-phenyl)-3-(2-ethoxyethylsulfanyl)-1H-1,2,4-triazole CAS Name: 5-(5-chloro-2-methoxyphenyl)-3-(2-ethoxyethylthio)-1H-1,2,4-triazole IUPAC Name: 5-(5-chloro-2-methoxyphenyl)-3-(2-ethoxyethylsulfanyl)-1H-1,2,4-triazole Traditional Name: 5-(5-chloro-2-methoxy-phenyl)-3-(2-ethoxyethylthio)-1H-1,2,4-triazole Formula: C13H16ClN3O2S MolecularWeight: 313.80304

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCSC1=NNC(=N1)C2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CCOCCSC1=NNC(=N1)C2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C13H16ClN3O2S/c1-3-19-6-7-20-13-15-12(16-17-13)10-8-9(14)4-5-11(10)18-2/h4-5,8H,3,6-7H2,1-2H3,(H,15,16,17)