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

Systemtic Name: 3-(5-methylsulfanyl-4-pentyl-1,2,4-triazol-3-yl)propylazanium Openeye Name: 3-(5-methylsulfanyl-4-pentyl-1,2,4-triazol-3-yl)propylammonium CAS Name: 3-[5-(methylthio)-4-pentyl-1,2,4-triazol-3-yl]propylammonium IUPAC Name: 3-(5-methylsulfanyl-4-pentyl-1,2,4-triazol-3-yl)propylazanium Traditional Name: 3-[4-amyl-5-(methylthio)-1,2,4-triazol-3-yl]propylammonium Formula: C11H23N4S+ MolecularWeight: 243.39212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=NN=C1SC)CCC[NH3+]

Isomeric SMILES

CCCCCN1C(=NN=C1SC)CCC[NH3+]

InChI

InChI=1S/C11H22N4S/c1-3-4-5-9-15-10(7-6-8-12)13-14-11(15)16-2/h3-9,12H2,1-2H3/p+1