5-butyl-5-sulfanyl-1,3-diazinane-2,4,6-trione

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(=O)NC(=O)NC1=O)S

Isomeric SMILES

CCCCC1(C(=O)NC(=O)NC1=O)S

InChI

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