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

Systemtic Name: 3-[(2-butoxy-5-chloranyl-phenyl)methylsulfanyl]-5-ethyl-1H-1,2,4-triazole Openeye Name: 3-[(2-butoxy-5-chloro-phenyl)methylsulfanyl]-5-ethyl-1H-1,2,4-triazole CAS Name: 3-[(2-butoxy-5-chlorophenyl)methylthio]-5-ethyl-1H-1,2,4-triazole IUPAC Name: 3-[(2-butoxy-5-chlorophenyl)methylsulfanyl]-5-ethyl-1H-1,2,4-triazole Traditional Name: 3-[(2-butoxy-5-chloro-benzyl)thio]-5-ethyl-1H-1,2,4-triazole Formula: C15H20ClN3OS MolecularWeight: 325.8568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)Cl)CSC2=NNC(=N2)CC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)Cl)CSC2=NNC(=N2)CC

InChI

InChI=1S/C15H20ClN3OS/c1-3-5-8-20-13-7-6-12(16)9-11(13)10-21-15-17-14(4-2)18-19-15/h6-7,9H,3-5,8,10H2,1-2H3,(H,17,18,19)