N-(6-chloranylpyridin-3-yl)-2-[4-(4-methyl-1,4-diazepan-4-ium-1-yl)-6-oxidanylidene-pyridazin-1-yl]ethanamide

Systemtic Name: N-(6-chloranylpyridin-3-yl)-2-[4-(4-methyl-1,4-diazepan-4-ium-1-yl)-6-oxidanylidene-pyridazin-1-yl]ethanamide Openeye Name: N-(6-chloro-3-pyridyl)-2-[4-(4-methyl-1,4-diazepan-4-ium-1-yl)-6-oxo-pyridazin-1-yl]acetamide CAS Name: N-(6-chloro-3-pyridinyl)-2-[4-(4-methyl-1,4-diazepan-4-ium-1-yl)-6-oxo-1-pyridazinyl]acetamide IUPAC Name: N-(6-chloropyridin-3-yl)-2-[4-(4-methyl-1,4-diazepan-4-ium-1-yl)-6-oxopyridazin-1-yl]acetamide Traditional Name: N-(6-chloro-3-pyridyl)-2-[6-keto-4-(4-methyl-1,4-diazepan-4-ium-1-yl)pyridazin-1-yl]acetamide Formula: C17H22ClN6O2+ MolecularWeight: 377.84858

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C2=CC(=O)N(N=C2)CC(=O)NC3=CN=C(C=C3)Cl

Isomeric SMILES

C[NH+]1CCCN(CC1)C2=CC(=O)N(N=C2)CC(=O)NC3=CN=C(C=C3)Cl

InChI

InChI=1S/C17H21ClN6O2/c1-22-5-2-6-23(8-7-22)14-9-17(26)24(20-11-14)12-16(25)21-13-3-4-15(18)19-10-13/h3-4,9-11H,2,5-8,12H2,1H3,(H,21,25)/p+1