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

Systemtic Name: 6-(naphthalen-1-ylmethylsulfanyl)-3-pyridin-2-yl-[1,2,4]triazolo[4,3-b]pyridazine Openeye Name: 6-(1-naphthylmethylsulfanyl)-3-(2-pyridyl)-[1,2,4]triazolo[4,3-b]pyridazine CAS Name: 6-(1-naphthalenylmethylthio)-3-(2-pyridinyl)-[1,2,4]triazolo[4,3-b]pyridazine IUPAC Name: 6-(naphthalen-1-ylmethylsulfanyl)-3-pyridin-2-yl-[1,2,4]triazolo[4,3-b]pyridazine Traditional Name: 6-(1-naphthylmethylthio)-3-(2-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=CC=CC=N5)C=C3

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CSC3=NN4C(=NN=C4C5=CC=CC=N5)C=C3

InChI

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