3-(4-tert-butyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propylazanium

Systemtic Name: 3-(4-tert-butyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propylazanium Openeye Name: 3-(4-tert-butyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propylammonium CAS Name: 3-[4-tert-butyl-5-(methylthio)-1,2,4-triazol-3-yl]propylammonium IUPAC Name: 3-(4-tert-butyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propylazanium Traditional Name: 3-[4-tert-butyl-5-(methylthio)-1,2,4-triazol-3-yl]propylammonium Formula: C10H21N4S+ MolecularWeight: 229.36554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=NN=C1SC)CCC[NH3+]

Isomeric SMILES

CC(C)(C)N1C(=NN=C1SC)CCC[NH3+]

InChI

InChI=1S/C10H20N4S/c1-10(2,3)14-8(6-5-7-11)12-13-9(14)15-4/h5-7,11H2,1-4H3/p+1