5-propyl-5-(2-sulfanylethyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-propyl-5-(2-sulfanylethyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-propyl-5-(2-sulfanylethyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-(2-mercaptoethyl)-5-propyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-propyl-5-(2-sulfanylethyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-(2-mercaptoethyl)-5-propyl-barbituric acid Formula: C9H14N2O3S MolecularWeight: 230.28406

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(=O)NC(=O)NC1=O)CCS

Isomeric SMILES

CCCC1(C(=O)NC(=O)NC1=O)CCS

InChI

InChI=1S/C9H14N2O3S/c1-2-3-9(4-5-15)6(12)10-8(14)11-7(9)13/h15H,2-5H2,1H3,(H2,10,11,12,13,14)