5-piperazin-4-ium-1-ylsulfonyl-1H-pyrimidine-2,4-dione

Systemtic Name: 5-piperazin-4-ium-1-ylsulfonyl-1H-pyrimidine-2,4-dione Openeye Name: 5-piperazin-4-ium-1-ylsulfonyl-1H-pyrimidine-2,4-dione CAS Name: 5-(1-piperazin-4-iumylsulfonyl)-1H-pyrimidine-2,4-dione IUPAC Name: 5-piperazin-4-ium-1-ylsulfonyl-1H-pyrimidine-2,4-dione Traditional Name: 5-piperazin-4-ium-1-ylsulfonyluracil Formula: C8H13N4O4S+ MolecularWeight: 261.27822

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)S(=O)(=O)C2=CNC(=O)NC2=O

Isomeric SMILES

C1CN(CC[NH2+]1)S(=O)(=O)C2=CNC(=O)NC2=O

InChI

InChI=1S/C8H12N4O4S/c13-7-6(5-10-8(14)11-7)17(15,16)12-3-1-9-2-4-12/h5,9H,1-4H2,(H2,10,11,13,14)/p+1