3-[2-[2,6-bis(azanyl)-4-oxidanylidene-1H-pyrimidin-5-yl]ethyl]thiophene-2-carboxylic acid

Systemtic Name: 3-[2-[2,6-bis(azanyl)-4-oxidanylidene-1H-pyrimidin-5-yl]ethyl]thiophene-2-carboxylic acid Openeye Name: 3-[2-(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)ethyl]thiophene-2-carboxylic acid CAS Name: 3-[2-(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)ethyl]-2-thiophenecarboxylic acid IUPAC Name: 3-[2-(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)ethyl]thiophene-2-carboxylic acid Traditional Name: 3-[2-(2,6-diamino-4-keto-1H-pyrimidin-5-yl)ethyl]-2-thenoic acid Formula: C11H12N4O3S MolecularWeight: 280.30298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1CCC2=C(NC(=NC2=O)N)N)C(=O)O

Isomeric SMILES

C1=CSC(=C1CCC2=C(NC(=NC2=O)N)N)C(=O)O

InChI

InChI=1S/C11H12N4O3S/c12-8-6(9(16)15-11(13)14-8)2-1-5-3-4-19-7(5)10(17)18/h3-4H,1-2H2,(H,17,18)(H5,12,13,14,15,16)