5-ethyl-5-(3-methylbutylsulfanylmethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-ethyl-5-(3-methylbutylsulfanylmethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-ethyl-5-(isopentylsulfanylmethyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-ethyl-5-[(3-methylbutylthio)methyl]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-ethyl-5-(3-methylbutylsulfanylmethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-ethyl-5-[(isoamylthio)methyl]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C12H20N2O2S2 MolecularWeight: 288.4294

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)NC(=S)NC1=O)CSCCC(C)C

Isomeric SMILES

CCC1(C(=O)NC(=S)NC1=O)CSCCC(C)C

InChI

InChI=1S/C12H20N2O2S2/c1-4-12(7-18-6-5-8(2)3)9(15)13-11(17)14-10(12)16/h8H,4-7H2,1-3H3,(H2,13,14,15,16,17)