3-[4-(furan-2-ylmethyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]propylazanium

Systemtic Name: 3-[4-(furan-2-ylmethyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]propylazanium Openeye Name: 3-[4-(2-furylmethyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]propylammonium CAS Name: 3-[4-(2-furanylmethyl)-5-(methylthio)-1,2,4-triazol-3-yl]propylammonium IUPAC Name: 3-[4-(furan-2-ylmethyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]propylazanium Traditional Name: 3-[4-(2-furfuryl)-5-(methylthio)-1,2,4-triazol-3-yl]propylammonium Formula: C11H17N4OS+ MolecularWeight: 253.34388

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1CC2=CC=CO2)CCC[NH3+]

Isomeric SMILES

CSC1=NN=C(N1CC2=CC=CO2)CCC[NH3+]

InChI

InChI=1S/C11H16N4OS/c1-17-11-14-13-10(5-2-6-12)15(11)8-9-4-3-7-16-9/h3-4,7H,2,5-6,8,12H2,1H3/p+1