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

Systemtic Name: 3-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propan-1-amine Openeye Name: 3-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propan-1-amine CAS Name: 3-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-1-propanamine IUPAC Name: 3-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propan-1-amine Traditional Name: 3-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]propylamine Formula: C11H15N5S MolecularWeight: 249.3353

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCCN)C2=CC=NC=C2

Isomeric SMILES

CN1C(=NN=C1SCCCN)C2=CC=NC=C2

InChI

InChI=1S/C11H15N5S/c1-16-10(9-3-6-13-7-4-9)14-15-11(16)17-8-2-5-12/h3-4,6-7H,2,5,8,12H2,1H3