5-ethyl-5-hex-3-yn-2-yl-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-ethyl-5-hex-3-yn-2-yl-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-ethyl-1-methyl-5-(1-methylpent-2-ynyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-ethyl-5-hex-3-yn-2-yl-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-ethyl-5-hex-3-yn-2-yl-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-ethyl-1-methyl-5-(1-methylpent-2-ynyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C13H18N2O2S MolecularWeight: 266.35922

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CC(C)C1(C(=O)NC(=S)N(C1=O)C)CC

Isomeric SMILES

CCC#CC(C)C1(C(=O)NC(=S)N(C1=O)C)CC

InChI

InChI=1S/C13H18N2O2S/c1-5-7-8-9(3)13(6-2)10(16)14-12(18)15(4)11(13)17/h9H,5-6H2,1-4H3,(H,14,16,18)