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

Systemtic Name: 5-[(5-morpholin-4-ylfuran-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(5-morpholino-2-furyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[5-(4-morpholinyl)-2-furanyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(5-morpholin-4-ylfuran-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(5-morpholino-2-furyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C13H13N3O4S MolecularWeight: 307.32502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(O2)C=C3C(=O)NC(=S)NC3=O

Isomeric SMILES

C1COCCN1C2=CC=C(O2)C=C3C(=O)NC(=S)NC3=O

InChI

InChI=1S/C13H13N3O4S/c17-11-9(12(18)15-13(21)14-11)7-8-1-2-10(20-8)16-3-5-19-6-4-16/h1-2,7H,3-6H2,(H2,14,15,17,18,21)