5-[C-methyl-N-(2-piperazine-1,4-diium-1-ylethyl)carbonimidoyl]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[C-methyl-N-(2-piperazine-1,4-diium-1-ylethyl)carbonimidoyl]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione Openeye Name: 1-allyl-5-[C-methyl-N-(2-piperazine-1,4-diium-1-ylethyl)carbonimidoyl]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[1-[2-(1-piperazine-1,4-diiumyl)ethylimino]ethyl]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[C-methyl-N-(2-piperazine-1,4-diium-1-ylethyl)carbonimidoyl]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione Traditional Name: 1-allyl-5-[C-methyl-N-(2-piperazine-1,4-diium-1-ylethyl)carbonimidoyl]barbituric acid Formula: C15H25N5O3+2 MolecularWeight: 323.3907

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NCC[NH+]1CC[NH2+]CC1)C2C(=O)NC(=O)N(C2=O)CC=C

Isomeric SMILES

CC(=NCC[NH+]1CC[NH2+]CC1)C2C(=O)NC(=O)N(C2=O)CC=C

InChI

InChI=1S/C15H23N5O3/c1-3-7-20-14(22)12(13(21)18-15(20)23)11(2)17-6-10-19-8-4-16-5-9-19/h3,12,16H,1,4-10H2,2H3,(H,18,21,23)/p+2