3-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propylazanium

Systemtic Name: 3-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propylazanium Openeye Name: 3-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propylammonium CAS Name: 3-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]propylammonium IUPAC Name: 3-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propylazanium Traditional Name: 3-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]propylammonium Formula: C12H16FN4S+ MolecularWeight: 267.345643

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCC[NH3+])C2=CC=C(C=C2)F

Isomeric SMILES

CN1C(=NN=C1SCCC[NH3+])C2=CC=C(C=C2)F

InChI

InChI=1S/C12H15FN4S/c1-17-11(9-3-5-10(13)6-4-9)15-16-12(17)18-8-2-7-14/h3-6H,2,7-8,14H2,1H3/p+1