1,1-bis(ethylsulfanyl)-1,3-diazinan-1-ium-2,4,6-trione

Systemtic Name: 1,1-bis(ethylsulfanyl)-1,3-diazinan-1-ium-2,4,6-trione Openeye Name: 1,1-bis(ethylsulfanyl)hexahydropyrimidin-1-ium-2,4,6-trione CAS Name: 1,1-bis(ethylthio)-1,3-diazinan-1-ium-2,4,6-trione IUPAC Name: 1,1-bis(ethylsulfanyl)-1,3-diazinan-1-ium-2,4,6-trione Traditional Name: 1,1-bis(ethylthio)hexahydropyrimidin-1-ium-2,4,6-trione Formula: C8H13N2O3S2+ MolecularWeight: 249.33042

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Descriptors Computed from Structure

Canonical SMILES:

CCS[N+]1(C(=O)CC(=O)NC1=O)SCC

Isomeric SMILES

CCS[N+]1(C(=O)CC(=O)NC1=O)SCC

InChI

InChI=1S/C8H12N2O3S2/c1-3-14-10(15-4-2)7(12)5-6(11)9-8(10)13/h3-5H2,1-2H3/p+1