5-butan-2-yl-5-but-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione; sodium

Systemtic Name: 5-butan-2-yl-5-but-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione; sodium Openeye Name: 5-but-2-enyl-5-sec-butyl-2-thioxo-hexahydropyrimidine-4,6-dione; sodium CAS Name: 5-butan-2-yl-5-but-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione; sodium IUPAC Name: 5-butan-2-yl-5-but-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione; sodium Traditional Name: 5-but-2-enyl-5-sec-butyl-2-thioxo-hexahydropyrimidine-4,6-quinone; sodium Formula: C12H18N2NaO2S MolecularWeight: 277.33829

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1(C(=O)NC(=S)NC1=O)CC=CC.[Na]

Isomeric SMILES

CCC(C)C1(C(=O)NC(=S)NC1=O)CC=CC.[Na]

InChI

InChI=1S/C12H18N2O2S.Na/c1-4-6-7-12(8(3)5-2)9(15)13-11(17)14-10(12)16;/h4,6,8H,5,7H2,1-3H3,(H2,13,14,15,16,17);