7-propyl-3-(pyridin-2-ylmethylsulfanyl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine

Systemtic Name: 7-propyl-3-(pyridin-2-ylmethylsulfanyl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine Openeye Name: 7-propyl-3-(2-pyridylmethylsulfanyl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine CAS Name: 7-propyl-3-(2-pyridinylmethylthio)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine IUPAC Name: 7-propyl-3-(pyridin-2-ylmethylsulfanyl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine Traditional Name: [7-propyl-3-(2-pyridylmethylthio)-[1,2,4]triazolo[4,3-c]pyrimidin-5-yl]amine Formula: C14H16N6S MolecularWeight: 300.38204

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=NN=C(N2C(=N1)N)SCC3=CC=CC=N3

Isomeric SMILES

CCCC1=CC2=NN=C(N2C(=N1)N)SCC3=CC=CC=N3

InChI

InChI=1S/C14H16N6S/c1-2-5-10-8-12-18-19-14(20(12)13(15)17-10)21-9-11-6-3-4-7-16-11/h3-4,6-8H,2,5,9H2,1H3,(H2,15,17)