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

Systemtic Name: 1-(5-chloranyl-2-methyl-phenyl)-5,5-bis(2-pyridin-2-ylethyl)-1,3-diazinane-2,4,6-trione Openeye Name: 1-(5-chloro-2-methyl-phenyl)-5,5-bis[2-(2-pyridyl)ethyl]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(5-chloro-2-methylphenyl)-5,5-bis[2-(2-pyridinyl)ethyl]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(5-chloro-2-methylphenyl)-5,5-bis(2-pyridin-2-ylethyl)-1,3-diazinane-2,4,6-trione Traditional Name: 1-(5-chloro-2-methyl-phenyl)-5,5-bis[2-(2-pyridyl)ethyl]barbituric acid Formula: C25H23ClN4O3 MolecularWeight: 462.92812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2C(=O)C(C(=O)NC2=O)(CCC3=CC=CC=N3)CCC4=CC=CC=N4

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2C(=O)C(C(=O)NC2=O)(CCC3=CC=CC=N3)CCC4=CC=CC=N4

InChI

InChI=1S/C25H23ClN4O3/c1-17-8-9-18(26)16-21(17)30-23(32)25(22(31)29-24(30)33,12-10-19-6-2-4-14-27-19)13-11-20-7-3-5-15-28-20/h2-9,14-16H,10-13H2,1H3,(H,29,31,33)