5-(1-oxidanylpiperidin-1-ium-1-yl)-5-thiophen-2-yl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-(1-oxidanylpiperidin-1-ium-1-yl)-5-thiophen-2-yl-1,3-diazinane-2,4,6-trione Openeye Name: 5-(1-hydroxypiperidin-1-ium-1-yl)-5-(2-thienyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-(1-hydroxy-1-piperidin-1-iumyl)-5-thiophen-2-yl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(1-hydroxypiperidin-1-ium-1-yl)-5-thiophen-2-yl-1,3-diazinane-2,4,6-trione Traditional Name: 5-(1-hydroxypiperidin-1-ium-1-yl)-5-(2-thienyl)barbituric acid Formula: C13H16N3O4S+ MolecularWeight: 310.34884

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](CC1)(C2(C(=O)NC(=O)NC2=O)C3=CC=CS3)O

Isomeric SMILES

C1CC[N+](CC1)(C2(C(=O)NC(=O)NC2=O)C3=CC=CS3)O

InChI

InChI=1S/C13H15N3O4S/c17-10-13(9-5-4-8-21-9,11(18)15-12(19)14-10)16(20)6-2-1-3-7-16/h4-5,8,20H,1-3,6-7H2,(H-,14,15,17,18,19)/p+1