1-[6-(4-methylsulfonylpiperazin-1-yl)pyridazin-3-yl]azepane

Systemtic Name: 1-[6-(4-methylsulfonylpiperazin-1-yl)pyridazin-3-yl]azepane Openeye Name: 1-[6-(4-methylsulfonylpiperazin-1-yl)pyridazin-3-yl]azepane CAS Name: 1-[6-(4-methylsulfonyl-1-piperazinyl)-3-pyridazinyl]azepane IUPAC Name: 1-[6-(4-methylsulfonylpiperazin-1-yl)pyridazin-3-yl]azepane Traditional Name: 1-[6-(4-mesylpiperazino)pyridazin-3-yl]azepane Formula: C15H25N5O2S MolecularWeight: 339.4563

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C2=NN=C(C=C2)N3CCCCCC3

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C2=NN=C(C=C2)N3CCCCCC3

InChI

InChI=1S/C15H25N5O2S/c1-23(21,22)20-12-10-19(11-13-20)15-7-6-14(16-17-15)18-8-4-2-3-5-9-18/h6-7H,2-5,8-13H2,1H3