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

Systemtic Name: 6-(naphthalen-1-ylmethylsulfanyl)-3-pyridin-3-yl-[1,2,4]triazolo[4,3-b]pyridazine Openeye Name: 6-(1-naphthylmethylsulfanyl)-3-(3-pyridyl)-[1,2,4]triazolo[4,3-b]pyridazine CAS Name: 6-(1-naphthalenylmethylthio)-3-(3-pyridinyl)-[1,2,4]triazolo[4,3-b]pyridazine IUPAC Name: 6-(naphthalen-1-ylmethylsulfanyl)-3-pyridin-3-yl-[1,2,4]triazolo[4,3-b]pyridazine Traditional Name: 6-(1-naphthylmethylthio)-3-(3-pyridyl)-[1,2,4]triazolo[4,3-b]pyridazine Formula: C21H15N5S MolecularWeight: 369.4423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CSC3=NN4C(=NN=C4C5=CN=CC=C5)C=C3

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CSC3=NN4C(=NN=C4C5=CN=CC=C5)C=C3

InChI

InChI=1S/C21H15N5S/c1-2-9-18-15(5-1)6-3-7-17(18)14-27-20-11-10-19-23-24-21(26(19)25-20)16-8-4-12-22-13-16/h1-13H,14H2