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

Systemtic Name: 3-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]propylazanium Openeye Name: 3-[[4-methyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propylammonium CAS Name: 3-[[4-methyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]propylammonium IUPAC Name: 3-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]propylazanium Traditional Name: 3-[[4-methyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]propylammonium Formula: C11H16N5S+ MolecularWeight: 250.34324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15N5S/c1-16-10(9-4-2-6-13-8-9)14-15-11(16)17-7-3-5-12/h2,4,6,8H,3,5,7,12H2,1H3/p+1