2-[1-[6-azanyl-1-methyl-2,4-bis(oxidanylidene)-3-propyl-pyrimidin-5-yl]-3-chloranyl-6-oxidanylidene-pyridazin-1-ium-1-yl]ethanamide

Systemtic Name: 2-[1-[6-azanyl-1-methyl-2,4-bis(oxidanylidene)-3-propyl-pyrimidin-5-yl]-3-chloranyl-6-oxidanylidene-pyridazin-1-ium-1-yl]ethanamide Openeye Name: 2-[1-(6-amino-1-methyl-2,4-dioxo-3-propyl-pyrimidin-5-yl)-3-chloro-6-oxo-pyridazin-1-ium-1-yl]acetamide CAS Name: 2-[1-(6-amino-1-methyl-2,4-dioxo-3-propyl-5-pyrimidinyl)-3-chloro-6-oxo-1-pyridazin-1-iumyl]acetamide IUPAC Name: 2-[1-(6-amino-1-methyl-2,4-dioxo-3-propylpyrimidin-5-yl)-3-chloro-6-oxopyridazin-1-ium-1-yl]acetamide Traditional Name: 2-[1-(6-amino-2,4-diketo-1-methyl-3-propyl-pyrimidin-5-yl)-3-chloro-6-keto-pyridazin-1-ium-1-yl]acetamide Formula: C14H18ClN6O4+ MolecularWeight: 369.78352

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C(=C(N(C1=O)C)N)[N+]2(C(=O)C=CC(=N2)Cl)CC(=O)N

Isomeric SMILES

CCCN1C(=O)C(=C(N(C1=O)C)N)[N+]2(C(=O)C=CC(=N2)Cl)CC(=O)N

InChI

InChI=1S/C14H17ClN6O4/c1-3-6-20-13(24)11(12(17)19(2)14(20)25)21(7-9(16)22)10(23)5-4-8(15)18-21/h4-5H,3,6-7H2,1-2H3,(H3-,16,17,22,24)/p+1