N-[6-azanyl-4-oxidanylidene-2-[(E)-2-oxidanyl-4-oxidanylidene-pent-2-en-3-yl]sulfanyl-1H-pyrimidin-5-yl]furan-2-carboxamide

Systemtic Name: N-[6-azanyl-4-oxidanylidene-2-[(E)-2-oxidanyl-4-oxidanylidene-pent-2-en-3-yl]sulfanyl-1H-pyrimidin-5-yl]furan-2-carboxamide Openeye Name: N-[2-[(E)-1-acetyl-2-hydroxy-prop-1-enyl]sulfanyl-6-amino-4-oxo-1H-pyrimidin-5-yl]furan-2-carboxamide CAS Name: N-[6-amino-2-[[(E)-2-hydroxy-4-oxopent-2-en-3-yl]thio]-4-oxo-1H-pyrimidin-5-yl]-2-furancarboxamide IUPAC Name: N-[6-amino-2-[(E)-2-hydroxy-4-oxopent-2-en-3-yl]sulfanyl-4-oxo-1H-pyrimidin-5-yl]furan-2-carboxamide Traditional Name: N-[2-[[(E)-1-acetyl-2-hydroxy-prop-1-enyl]thio]-6-amino-4-keto-1H-pyrimidin-5-yl]-2-furamide Formula: C14H14N4O5S MolecularWeight: 350.34976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)C)SC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=CO2)O

Isomeric SMILES

C/C(=C(/C(=O)C)\SC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=CO2)/O

InChI

InChI=1S/C14H14N4O5S/c1-6(19)10(7(2)20)24-14-17-11(15)9(13(22)18-14)16-12(21)8-4-3-5-23-8/h3-5,19H,1-2H3,(H,16,21)(H3,15,17,18,22)/b10-6+