5-octadecyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-octadecyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-octadecyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-octadecyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-octadecyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-stearyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C22H40N2O2S MolecularWeight: 396.6302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1C(=O)NC(=S)NC1=O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1C(=O)NC(=S)NC1=O

InChI

InChI=1S/C22H40N2O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(25)23-22(27)24-21(19)26/h19H,2-18H2,1H3,(H2,23,24,25,26,27)