5-(1,3-benzodioxol-5-ylmethyl)-1,3-dimethyl-5-(2-pyridin-4-ylethyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethyl)-1,3-dimethyl-5-(2-pyridin-4-ylethyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-(1,3-benzodioxol-5-ylmethyl)-1,3-dimethyl-5-[2-(4-pyridyl)ethyl]hexahydropyrimidine-2,4,6-trione CAS Name: 5-(1,3-benzodioxol-5-ylmethyl)-1,3-dimethyl-5-(2-pyridin-4-ylethyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(1,3-benzodioxol-5-ylmethyl)-1,3-dimethyl-5-(2-pyridin-4-ylethyl)-1,3-diazinane-2,4,6-trione Traditional Name: 1,3-dimethyl-5-piperonyl-5-[2-(4-pyridyl)ethyl]barbituric acid Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(C(=O)N(C1=O)C)(CCC2=CC=NC=C2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1C(=O)C(C(=O)N(C1=O)C)(CCC2=CC=NC=C2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H21N3O5/c1-23-18(25)21(19(26)24(2)20(23)27,8-5-14-6-9-22-10-7-14)12-15-3-4-16-17(11-15)29-13-28-16/h3-4,6-7,9-11H,5,8,12-13H2,1-2H3