5-[1-(2-piperazin-4-ium-1-ylethylamino)ethylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[1-(2-piperazin-4-ium-1-ylethylamino)ethylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione Openeye Name: 1-allyl-5-[1-(2-piperazin-4-ium-1-ylethylamino)ethylidene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[1-[2-(1-piperazin-4-iumyl)ethylamino]ethylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[1-(2-piperazin-4-ium-1-ylethylamino)ethylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione Traditional Name: 1-allyl-5-[1-(2-piperazin-4-ium-1-ylethylamino)ethylidene]barbituric acid Formula: C15H24N5O3+ MolecularWeight: 322.38276

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C(=O)NC(=O)N(C1=O)CC=C)NCCN2CC[NH2+]CC2

Isomeric SMILES

CC(=C1C(=O)NC(=O)N(C1=O)CC=C)NCCN2CC[NH2+]CC2

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/h3,16-17H,1,4-10H2,2H3,(H,18,21,23)/p+1