5-(2-azanyl-5-cyano-6-methylsulfanyl-pyrimidin-4-yl)furan-2-carboxylic acid

Systemtic Name: 5-(2-azanyl-5-cyano-6-methylsulfanyl-pyrimidin-4-yl)furan-2-carboxylic acid Openeye Name: 5-(2-amino-5-cyano-6-methylsulfanyl-pyrimidin-4-yl)furan-2-carboxylic acid CAS Name: 5-[2-amino-5-cyano-6-(methylthio)-4-pyrimidinyl]-2-furancarboxylic acid IUPAC Name: 5-(2-amino-5-cyano-6-methylsulfanylpyrimidin-4-yl)furan-2-carboxylic acid Traditional Name: 5-[2-amino-5-cyano-6-(methylthio)pyrimidin-4-yl]-2-furoic acid Formula: C11H8N4O3S MolecularWeight: 276.27122

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC(=C1C#N)C2=CC=C(O2)C(=O)O)N

Isomeric SMILES

CSC1=NC(=NC(=C1C#N)C2=CC=C(O2)C(=O)O)N

InChI

InChI=1S/C11H8N4O3S/c1-19-9-5(4-12)8(14-11(13)15-9)6-2-3-7(18-6)10(16)17/h2-3H,1H3,(H,16,17)(H2,13,14,15)