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

Systemtic Name: 5-octyl-5-(2-pyridin-4-ylethyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-octyl-5-[2-(4-pyridyl)ethyl]hexahydropyrimidine-2,4,6-trione CAS Name: 5-octyl-5-(2-pyridin-4-ylethyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-octyl-5-(2-pyridin-4-ylethyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-octyl-5-[2-(4-pyridyl)ethyl]barbituric acid Formula: C19H27N3O3 MolecularWeight: 345.43598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1(C(=O)NC(=O)NC1=O)CCC2=CC=NC=C2

Isomeric SMILES

CCCCCCCCC1(C(=O)NC(=O)NC1=O)CCC2=CC=NC=C2

InChI

InChI=1S/C19H27N3O3/c1-2-3-4-5-6-7-11-19(12-8-15-9-13-20-14-10-15)16(23)21-18(25)22-17(19)24/h9-10,13-14H,2-8,11-12H2,1H3,(H2,21,22,23,24,25)