3-[(5-chloranyl-2-methoxy-phenyl)methylsulfanyl]-5-ethyl-1H-1,2,4-triazole

Systemtic Name: 3-[(5-chloranyl-2-methoxy-phenyl)methylsulfanyl]-5-ethyl-1H-1,2,4-triazole Openeye Name: 3-[(5-chloro-2-methoxy-phenyl)methylsulfanyl]-5-ethyl-1H-1,2,4-triazole CAS Name: 3-[(5-chloro-2-methoxyphenyl)methylthio]-5-ethyl-1H-1,2,4-triazole IUPAC Name: 3-[(5-chloro-2-methoxyphenyl)methylsulfanyl]-5-ethyl-1H-1,2,4-triazole Traditional Name: 3-[(5-chloro-2-methoxy-benzyl)thio]-5-ethyl-1H-1,2,4-triazole Formula: C12H14ClN3OS MolecularWeight: 283.77706

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NN1)SCC2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CCC1=NC(=NN1)SCC2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C12H14ClN3OS/c1-3-11-14-12(16-15-11)18-7-8-6-9(13)4-5-10(8)17-2/h4-6H,3,7H2,1-2H3,(H,14,15,16)