5-(prop-2-ynyliminomethyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-(prop-2-ynyliminomethyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-(prop-2-ynyliminomethyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-(prop-2-ynyliminomethyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(prop-2-ynyliminomethyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-(propargyliminomethyl)barbituric acid Formula: C8H7N3O3 MolecularWeight: 193.15948

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN=CC1C(=O)NC(=O)NC1=O

Isomeric SMILES

C#CCN=CC1C(=O)NC(=O)NC1=O

InChI

InChI=1S/C8H7N3O3/c1-2-3-9-4-5-6(12)10-8(14)11-7(5)13/h1,4-5H,3H2,(H2,10,11,12,13,14)