3-[4-(4-chloranylphenoxy)butylsulfanyl]-1H-1,2,4-triazol-5-amine

Systemtic Name: 3-[4-(4-chloranylphenoxy)butylsulfanyl]-1H-1,2,4-triazol-5-amine Openeye Name: 3-[4-(4-chlorophenoxy)butylsulfanyl]-1H-1,2,4-triazol-5-amine CAS Name: 3-[4-(4-chlorophenoxy)butylthio]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-[4-(4-chlorophenoxy)butylsulfanyl]-1H-1,2,4-triazol-5-amine Traditional Name: [3-[4-(4-chlorophenoxy)butylthio]-1H-1,2,4-triazol-5-yl]amine Formula: C12H15ClN4OS MolecularWeight: 298.7917

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCCCSC2=NNC(=N2)N)Cl

Isomeric SMILES

C1=CC(=CC=C1OCCCCSC2=NNC(=N2)N)Cl

InChI

InChI=1S/C12H15ClN4OS/c13-9-3-5-10(6-4-9)18-7-1-2-8-19-12-15-11(14)16-17-12/h3-6H,1-2,7-8H2,(H3,14,15,16,17)