1,3-dimethyl-5-[[(4-methylpiperazin-4-ium-1-yl)amino]methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1,3-dimethyl-5-[[(4-methylpiperazin-4-ium-1-yl)amino]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1,3-dimethyl-5-[[(4-methylpiperazin-4-ium-1-yl)amino]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1,3-dimethyl-5-[[(4-methyl-1-piperazin-4-iumyl)amino]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1,3-dimethyl-5-[[(4-methylpiperazin-4-ium-1-yl)amino]methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1,3-dimethyl-5-[[(4-methylpiperazin-4-ium-1-yl)amino]methylene]barbituric acid Formula: C12H20N5O3+ MolecularWeight: 282.3189

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC=C2C(=O)N(C(=O)N(C2=O)C)C

Isomeric SMILES

C[NH+]1CCN(CC1)NC=C2C(=O)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C12H19N5O3/c1-14-4-6-17(7-5-14)13-8-9-10(18)15(2)12(20)16(3)11(9)19/h8,13H,4-7H2,1-3H3/p+1