5-butyl-5-pentan-2-yl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-butyl-5-pentan-2-yl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-butyl-5-(1-methylbutyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-butyl-5-pentan-2-yl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-butyl-5-pentan-2-yl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-butyl-5-(1-methylbutyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C13H22N2O2S MolecularWeight: 270.39098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(=O)NC(=S)NC1=O)C(C)CCC

Isomeric SMILES

CCCCC1(C(=O)NC(=S)NC1=O)C(C)CCC

InChI

InChI=1S/C13H22N2O2S/c1-4-6-8-13(9(3)7-5-2)10(16)14-12(18)15-11(13)17/h9H,4-8H2,1-3H3,(H2,14,15,16,17,18)