1-[5-(6-chloranylpyridazin-3-yl)-2-methyl-phenyl]sulfonylazepane

Systemtic Name: 1-[5-(6-chloranylpyridazin-3-yl)-2-methyl-phenyl]sulfonylazepane Openeye Name: 1-[5-(6-chloropyridazin-3-yl)-2-methyl-phenyl]sulfonylazepane CAS Name: 1-[5-(6-chloro-3-pyridazinyl)-2-methylphenyl]sulfonylazepane IUPAC Name: 1-[5-(6-chloropyridazin-3-yl)-2-methylphenyl]sulfonylazepane Traditional Name: 1-[5-(6-chloropyridazin-3-yl)-2-methyl-phenyl]sulfonylazepane Formula: C17H20ClN3O2S MolecularWeight: 365.8776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C17H20ClN3O2S/c1-13-6-7-14(15-8-9-17(18)20-19-15)12-16(13)24(22,23)21-10-4-2-3-5-11-21/h6-9,12H,2-5,10-11H2,1H3