3-pyridin-4-yl-6-(pyridin-2-ylmethylsulfanyl)-[1,2,4]triazolo[4,3-b]pyridazine

Systemtic Name: 3-pyridin-4-yl-6-(pyridin-2-ylmethylsulfanyl)-[1,2,4]triazolo[4,3-b]pyridazine Openeye Name: 3-(4-pyridyl)-6-(2-pyridylmethylsulfanyl)-[1,2,4]triazolo[4,3-b]pyridazine CAS Name: 3-pyridin-4-yl-6-(2-pyridinylmethylthio)-[1,2,4]triazolo[4,3-b]pyridazine IUPAC Name: 3-pyridin-4-yl-6-(pyridin-2-ylmethylsulfanyl)-[1,2,4]triazolo[4,3-b]pyridazine Traditional Name: 3-(4-pyridyl)-6-(2-pyridylmethylthio)-[1,2,4]triazolo[4,3-b]pyridazine Formula: C16H12N6S MolecularWeight: 320.37168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CSC2=NN3C(=NN=C3C4=CC=NC=C4)C=C2

Isomeric SMILES

C1=CC=NC(=C1)CSC2=NN3C(=NN=C3C4=CC=NC=C4)C=C2

InChI

InChI=1S/C16H12N6S/c1-2-8-18-13(3-1)11-23-15-5-4-14-19-20-16(22(14)21-15)12-6-9-17-10-7-12/h1-10H,11H2