5-(2-ethylhexyl)-2-sulfanylidene-1,3-diazinane-4,6-dione; sodium

Systemtic Name: 5-(2-ethylhexyl)-2-sulfanylidene-1,3-diazinane-4,6-dione; sodium Openeye Name: 5-(2-ethylhexyl)-2-thioxo-hexahydropyrimidine-4,6-dione; sodium CAS Name: 5-(2-ethylhexyl)-2-sulfanylidene-1,3-diazinane-4,6-dione; sodium IUPAC Name: 5-(2-ethylhexyl)-2-sulfanylidene-1,3-diazinane-4,6-dione; sodium Traditional Name: 5-(2-ethylhexyl)-2-thioxo-hexahydropyrimidine-4,6-quinone; sodium Formula: C12H20N2NaO2S MolecularWeight: 279.35417

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC1C(=O)NC(=S)NC1=O.[Na]

Isomeric SMILES

CCCCC(CC)CC1C(=O)NC(=S)NC1=O.[Na]

InChI

InChI=1S/C12H20N2O2S.Na/c1-3-5-6-8(4-2)7-9-10(15)13-12(17)14-11(9)16;/h8-9H,3-7H2,1-2H3,(H2,13,14,15,16,17);