3-[2-(2-bromanyl-4-chloranyl-phenoxy)ethylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-amine

Systemtic Name: 3-[2-(2-bromanyl-4-chloranyl-phenoxy)ethylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-amine Openeye Name: 3-[2-(2-bromo-4-chloro-phenoxy)ethylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-amine CAS Name: 3-[2-(2-bromo-4-chlorophenoxy)ethylthio]-5-cyclopropyl-1,2,4-triazol-4-amine IUPAC Name: 3-[2-(2-bromo-4-chlorophenoxy)ethylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-amine Traditional Name: [3-[2-(2-bromo-4-chloro-phenoxy)ethylthio]-5-cyclopropyl-1,2,4-triazol-4-yl]amine Formula: C13H14BrClN4OS MolecularWeight: 389.69846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2N)SCCOC3=C(C=C(C=C3)Cl)Br

Isomeric SMILES

C1CC1C2=NN=C(N2N)SCCOC3=C(C=C(C=C3)Cl)Br

InChI

InChI=1S/C13H14BrClN4OS/c14-10-7-9(15)3-4-11(10)20-5-6-21-13-18-17-12(19(13)16)8-1-2-8/h3-4,7-8H,1-2,5-6,16H2