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

Systemtic Name: 3-[(3-chlorophenyl)methylsulfanyl]-6-pyridin-2-yl-[1,2,4]triazolo[4,3-b]pyridazine Openeye Name: 3-[(3-chlorophenyl)methylsulfanyl]-6-(2-pyridyl)-[1,2,4]triazolo[4,3-b]pyridazine CAS Name: 3-[(3-chlorophenyl)methylthio]-6-(2-pyridinyl)-[1,2,4]triazolo[4,3-b]pyridazine IUPAC Name: 3-[(3-chlorophenyl)methylsulfanyl]-6-pyridin-2-yl-[1,2,4]triazolo[4,3-b]pyridazine Traditional Name: 3-[(3-chlorobenzyl)thio]-6-(2-pyridyl)-[1,2,4]triazolo[4,3-b]pyridazine Formula: C17H12ClN5S MolecularWeight: 353.82868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=NN3C(=NN=C3SCC4=CC(=CC=C4)Cl)C=C2

Isomeric SMILES

C1=CC=NC(=C1)C2=NN3C(=NN=C3SCC4=CC(=CC=C4)Cl)C=C2

InChI

InChI=1S/C17H12ClN5S/c18-13-5-3-4-12(10-13)11-24-17-21-20-16-8-7-15(22-23(16)17)14-6-1-2-9-19-14/h1-10H,11H2