N-(2,3-dimethylpyridin-4-yl)-2-(6-oxidanylidene-4-piperazin-4-ium-1-yl-pyridazin-1-yl)ethanamide

Systemtic Name: N-(2,3-dimethylpyridin-4-yl)-2-(6-oxidanylidene-4-piperazin-4-ium-1-yl-pyridazin-1-yl)ethanamide Openeye Name: N-(2,3-dimethyl-4-pyridyl)-2-(6-oxo-4-piperazin-4-ium-1-yl-pyridazin-1-yl)acetamide CAS Name: N-(2,3-dimethyl-4-pyridinyl)-2-[6-oxo-4-(1-piperazin-4-iumyl)-1-pyridazinyl]acetamide IUPAC Name: N-(2,3-dimethylpyridin-4-yl)-2-(6-oxo-4-piperazin-4-ium-1-ylpyridazin-1-yl)acetamide Traditional Name: N-(2,3-dimethyl-4-pyridyl)-2-(6-keto-4-piperazin-4-ium-1-yl-pyridazin-1-yl)acetamide Formula: C17H23N6O2+ MolecularWeight: 343.40352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1C)NC(=O)CN2C(=O)C=C(C=N2)N3CC[NH2+]CC3

Isomeric SMILES

CC1=C(C=CN=C1C)NC(=O)CN2C(=O)C=C(C=N2)N3CC[NH2+]CC3

InChI

InChI=1S/C17H22N6O2/c1-12-13(2)19-4-3-15(12)21-16(24)11-23-17(25)9-14(10-20-23)22-7-5-18-6-8-22/h3-4,9-10,18H,5-8,11H2,1-2H3,(H,19,21,24)/p+1