1-methyl-5-propyl-5-sulfanyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-methyl-5-propyl-5-sulfanyl-1,3-diazinane-2,4,6-trione Openeye Name: 1-methyl-5-propyl-5-sulfanyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-mercapto-1-methyl-5-propyl-1,3-diazinane-2,4,6-trione IUPAC Name: 1-methyl-5-propyl-5-sulfanyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-mercapto-1-methyl-5-propyl-barbituric acid Formula: C8H12N2O3S MolecularWeight: 216.25748

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(=O)NC(=O)N(C1=O)C)S

Isomeric SMILES

CCCC1(C(=O)NC(=O)N(C1=O)C)S

InChI

InChI=1S/C8H12N2O3S/c1-3-4-8(14)5(11)9-7(13)10(2)6(8)12/h14H,3-4H2,1-2H3,(H,9,11,13)