3-[2-(3-bromanylphenoxy)ethylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-amine

Systemtic Name: 3-[2-(3-bromanylphenoxy)ethylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-amine Openeye Name: 3-[2-(3-bromophenoxy)ethylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-amine CAS Name: 3-[2-(3-bromophenoxy)ethylthio]-5-cyclopropyl-1,2,4-triazol-4-amine IUPAC Name: 3-[2-(3-bromophenoxy)ethylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-amine Traditional Name: [3-[2-(3-bromophenoxy)ethylthio]-5-cyclopropyl-1,2,4-triazol-4-yl]amine Formula: C13H15BrN4OS MolecularWeight: 355.2534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15BrN4OS/c14-10-2-1-3-11(8-10)19-6-7-20-13-17-16-12(18(13)15)9-4-5-9/h1-3,8-9H,4-7,15H2