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

Systemtic Name: 6-pyridin-3-yl-3-(pyridin-2-ylmethylsulfanyl)-[1,2,4]triazolo[4,3-b]pyridazine Openeye Name: 6-(3-pyridyl)-3-(2-pyridylmethylsulfanyl)-[1,2,4]triazolo[4,3-b]pyridazine CAS Name: 6-(3-pyridinyl)-3-(2-pyridinylmethylthio)-[1,2,4]triazolo[4,3-b]pyridazine IUPAC Name: 6-pyridin-3-yl-3-(pyridin-2-ylmethylsulfanyl)-[1,2,4]triazolo[4,3-b]pyridazine Traditional Name: 6-(3-pyridyl)-3-(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=NN=C3N2N=C(C=C3)C4=CN=CC=C4

Isomeric SMILES

C1=CC=NC(=C1)CSC2=NN=C3N2N=C(C=C3)C4=CN=CC=C4

InChI

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