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

Systemtic Name: 3-phenyl-6-(pyridin-3-ylmethylsulfanyl)-[1,2,4]triazolo[4,3-b]pyridazine Openeye Name: 3-phenyl-6-(3-pyridylmethylsulfanyl)-[1,2,4]triazolo[4,3-b]pyridazine CAS Name: 3-phenyl-6-(3-pyridinylmethylthio)-[1,2,4]triazolo[4,3-b]pyridazine IUPAC Name: 3-phenyl-6-(pyridin-3-ylmethylsulfanyl)-[1,2,4]triazolo[4,3-b]pyridazine Traditional Name: 3-phenyl-6-(3-pyridylmethylthio)-[1,2,4]triazolo[4,3-b]pyridazine Formula: C17H13N5S MolecularWeight: 319.38362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C3N2N=C(C=C3)SCC4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C3N2N=C(C=C3)SCC4=CN=CC=C4

InChI

InChI=1S/C17H13N5S/c1-2-6-14(7-3-1)17-20-19-15-8-9-16(21-22(15)17)23-12-13-5-4-10-18-11-13/h1-11H,12H2