5,5-bis(2-pyridin-2-ylethyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5,5-bis(2-pyridin-2-ylethyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5,5-bis[2-(2-pyridyl)ethyl]hexahydropyrimidine-2,4,6-trione CAS Name: 5,5-bis[2-(2-pyridinyl)ethyl]-1,3-diazinane-2,4,6-trione IUPAC Name: 5,5-bis(2-pyridin-2-ylethyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5,5-bis[2-(2-pyridyl)ethyl]barbituric acid Formula: C18H18N4O3 MolecularWeight: 338.36052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CCC2(C(=O)NC(=O)NC2=O)CCC3=CC=CC=N3

Isomeric SMILES

C1=CC=NC(=C1)CCC2(C(=O)NC(=O)NC2=O)CCC3=CC=CC=N3

InChI

InChI=1S/C18H18N4O3/c23-15-18(16(24)22-17(25)21-15,9-7-13-5-1-3-11-19-13)10-8-14-6-2-4-12-20-14/h1-6,11-12H,7-10H2,(H2,21,22,23,24,25)