5-[[[2-methyl-1,3-bis(oxidanyl)propan-2-yl]amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[[[2-methyl-1,3-bis(oxidanyl)propan-2-yl]amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[[[2-hydroxy-1-(hydroxymethyl)-1-methyl-ethyl]amino]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[(1,3-dihydroxy-2-methylpropan-2-yl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[[(1,3-dihydroxy-2-methylpropan-2-yl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[[(2-hydroxy-1-methyl-1-methylol-ethyl)amino]methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C9H13N3O4S MolecularWeight: 259.28222

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(CO)NC=C1C(=O)NC(=S)NC1=O

Isomeric SMILES

CC(CO)(CO)NC=C1C(=O)NC(=S)NC1=O

InChI

InChI=1S/C9H13N3O4S/c1-9(3-13,4-14)10-2-5-6(15)11-8(17)12-7(5)16/h2,10,13-14H,3-4H2,1H3,(H2,11,12,15,16,17)