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

Systemtic Name: 5-(3-methylbutyl)-5-(2-pyridin-4-ylethyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-isopentyl-5-[2-(4-pyridyl)ethyl]hexahydropyrimidine-2,4,6-trione CAS Name: 5-(3-methylbutyl)-5-(2-pyridin-4-ylethyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(3-methylbutyl)-5-(2-pyridin-4-ylethyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-isoamyl-5-[2-(4-pyridyl)ethyl]barbituric acid Formula: C16H21N3O3 MolecularWeight: 303.35624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1(C(=O)NC(=O)NC1=O)CCC2=CC=NC=C2

Isomeric SMILES

CC(C)CCC1(C(=O)NC(=O)NC1=O)CCC2=CC=NC=C2

InChI

InChI=1S/C16H21N3O3/c1-11(2)3-7-16(8-4-12-5-9-17-10-6-12)13(20)18-15(22)19-14(16)21/h5-6,9-11H,3-4,7-8H2,1-2H3,(H2,18,19,20,21,22)