5-(butylsulfanylmethyl)-5-(2-methylpropyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-(butylsulfanylmethyl)-5-(2-methylpropyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-(butylsulfanylmethyl)-5-isobutyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(butylthio)methyl]-5-(2-methylpropyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(butylsulfanylmethyl)-5-(2-methylpropyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-[(butylthio)methyl]-5-isobutyl-barbituric acid Formula: C13H22N2O3S MolecularWeight: 286.39038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC1(C(=O)NC(=O)NC1=O)CC(C)C

Isomeric SMILES

CCCCSCC1(C(=O)NC(=O)NC1=O)CC(C)C

InChI

InChI=1S/C13H22N2O3S/c1-4-5-6-19-8-13(7-9(2)3)10(16)14-12(18)15-11(13)17/h9H,4-8H2,1-3H3,(H2,14,15,16,17,18)