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

Systemtic Name: N-(1-ethyl-1,2,3-triazol-4-yl)-2-[4-(4-methyl-1,4-diazepan-4-ium-1-yl)-6-oxidanylidene-pyridazin-1-yl]ethanamide Openeye Name: N-(1-ethyltriazol-4-yl)-2-[4-(4-methyl-1,4-diazepan-4-ium-1-yl)-6-oxo-pyridazin-1-yl]acetamide CAS Name: N-(1-ethyl-4-triazolyl)-2-[4-(4-methyl-1,4-diazepan-4-ium-1-yl)-6-oxo-1-pyridazinyl]acetamide IUPAC Name: N-(1-ethyltriazol-4-yl)-2-[4-(4-methyl-1,4-diazepan-4-ium-1-yl)-6-oxopyridazin-1-yl]acetamide Traditional Name: N-(1-ethyltriazol-4-yl)-2-[6-keto-4-(4-methyl-1,4-diazepan-4-ium-1-yl)pyridazin-1-yl]acetamide Formula: C16H25N8O2+ MolecularWeight: 361.4221

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(N=N1)NC(=O)CN2C(=O)C=C(C=N2)N3CCC[NH+](CC3)C

Isomeric SMILES

CCN1C=C(N=N1)NC(=O)CN2C(=O)C=C(C=N2)N3CCC[NH+](CC3)C

InChI

InChI=1S/C16H24N8O2/c1-3-23-11-14(19-20-23)18-15(25)12-24-16(26)9-13(10-17-24)22-6-4-5-21(2)7-8-22/h9-11H,3-8,12H2,1-2H3,(H,18,25)/p+1