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

Systemtic Name: 1-phenethyl-5,5-bis(2-pyridin-4-ylethyl)-1,3-diazinane-2,4,6-trione Openeye Name: 1-phenethyl-5,5-bis[2-(4-pyridyl)ethyl]hexahydropyrimidine-2,4,6-trione CAS Name: 1-phenethyl-5,5-bis(2-pyridin-4-ylethyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 1-phenethyl-5,5-bis(2-pyridin-4-ylethyl)-1,3-diazinane-2,4,6-trione Traditional Name: 1-phenethyl-5,5-bis[2-(4-pyridyl)ethyl]barbituric acid Formula: C26H26N4O3 MolecularWeight: 442.50964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=O)C(C(=O)NC2=O)(CCC3=CC=NC=C3)CCC4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=O)C(C(=O)NC2=O)(CCC3=CC=NC=C3)CCC4=CC=NC=C4

InChI

InChI=1S/C26H26N4O3/c31-23-26(13-6-21-8-15-27-16-9-21,14-7-22-10-17-28-18-11-22)24(32)30(25(33)29-23)19-12-20-4-2-1-3-5-20/h1-5,8-11,15-18H,6-7,12-14,19H2,(H,29,31,33)