8-(3-methylsulfonylphenyl)-6-piperidin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine

Systemtic Name: 8-(3-methylsulfonylphenyl)-6-piperidin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine Openeye Name: 8-(3-methylsulfonylphenyl)-6-(1-piperidyl)-[1,2,4]triazolo[4,3-b]pyridazine CAS Name: 8-(3-methylsulfonylphenyl)-6-(1-piperidinyl)-[1,2,4]triazolo[4,3-b]pyridazine IUPAC Name: 8-(3-methylsulfonylphenyl)-6-piperidin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine Traditional Name: 8-(3-mesylphenyl)-6-piperidino-[1,2,4]triazolo[4,3-b]pyridazine Formula: C17H19N5O2S MolecularWeight: 357.43006

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C2=CC(=NN3C2=NN=C3)N4CCCCC4

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C2=CC(=NN3C2=NN=C3)N4CCCCC4

InChI

InChI=1S/C17H19N5O2S/c1-25(23,24)14-7-5-6-13(10-14)15-11-16(21-8-3-2-4-9-21)20-22-12-18-19-17(15)22/h5-7,10-12H,2-4,8-9H2,1H3