(5E)-1-butan-2-yl-5-[(furan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5E)-1-butan-2-yl-5-[(furan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5E)-5-[(2-furylmethylamino)methylene]-1-sec-butyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5E)-1-butan-2-yl-5-[(2-furanylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5E)-1-butan-2-yl-5-[(furan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5E)-5-[(2-furfurylamino)methylene]-1-sec-butyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C(=CNCC2=CC=CO2)C(=O)NC1=S

Isomeric SMILES

CCC(C)N1C(=O)/C(=C/NCC2=CC=CO2)/C(=O)NC1=S

InChI

InChI=1S/C14H17N3O3S/c1-3-9(2)17-13(19)11(12(18)16-14(17)21)8-15-7-10-5-4-6-20-10/h4-6,8-9,15H,3,7H2,1-2H3,(H,16,18,21)/b11-8+