4-[4-(2H-1,2,3-triazol-4-ylsulfanyl)butylsulfanyl]-2H-1,2,3-triazole

Systemtic Name: 4-[4-(2H-1,2,3-triazol-4-ylsulfanyl)butylsulfanyl]-2H-1,2,3-triazole Openeye Name: 4-[4-(2H-triazol-4-ylsulfanyl)butylsulfanyl]-2H-triazole CAS Name: 4-[4-(2H-triazol-4-ylthio)butylthio]-2H-triazole IUPAC Name: 4-[4-(2H-triazol-4-ylsulfanyl)butylsulfanyl]-2H-triazole Traditional Name: 4-[4-(2H-triazol-4-ylthio)butylthio]-2H-triazole Formula: C8H12N6S2 MolecularWeight: 256.35108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NNN=C1SCCCCSC2=NNN=C2

Isomeric SMILES

C1=NNN=C1SCCCCSC2=NNN=C2

InChI

InChI=1S/C8H12N6S2/c1(3-15-7-5-9-13-11-7)2-4-16-8-6-10-14-12-8/h5-6H,1-4H2,(H,9,11,13)(H,10,12,14)