1,3-bis(2-pyridin-2-ylethyl)-1,3-diazinane-2,4,6-trione chloride

Systemtic Name: 1,3-bis(2-pyridin-2-ylethyl)-1,3-diazinane-2,4,6-trione chloride Openeye Name: 1,3-bis[2-(2-pyridyl)ethyl]hexahydropyrimidine-2,4,6-trione chloride CAS Name: 1,3-bis[2-(2-pyridinyl)ethyl]-1,3-diazinane-2,4,6-trione chloride IUPAC Name: 1,3-bis(2-pyridin-2-ylethyl)-1,3-diazinane-2,4,6-trione chloride Traditional Name: 1,3-bis[2-(2-pyridyl)ethyl]barbituric acid chloride Formula: C18H18ClN4O3- MolecularWeight: 373.81352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C(=O)N(C1=O)CCC2=CC=CC=N2)CCC3=CC=CC=N3.[Cl-]

Isomeric SMILES

C1C(=O)N(C(=O)N(C1=O)CCC2=CC=CC=N2)CCC3=CC=CC=N3.[Cl-]

InChI

InChI=1S/C18H18N4O3.ClH/c23-16-13-17(24)22(12-8-15-6-2-4-10-20-15)18(25)21(16)11-7-14-5-1-3-9-19-14;/h1-6,9-10H,7-8,11-13H2;1H/p-1