5-[(octadecylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(octadecylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(octadecylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(octadecylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(octadecylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(stearylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C23H41N3O2S MolecularWeight: 423.65554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC=C1C(=O)NC(=S)NC1=O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC=C1C(=O)NC(=S)NC1=O

InChI

InChI=1S/C23H41N3O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-19-20-21(27)25-23(29)26-22(20)28/h19,24H,2-18H2,1H3,(H2,25,26,27,28,29)