3-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanoic acid

Systemtic Name: 3-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanoic acid Openeye Name: 3-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]propanoic acid CAS Name: 3-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]propanoic acid IUPAC Name: 3-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]propanoic acid Traditional Name: 3-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]propionic acid Formula: C7H9N3O3S MolecularWeight: 215.22966

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC(=NC1=O)SCCC(=O)O)N

Isomeric SMILES

C1=C(NC(=NC1=O)SCCC(=O)O)N

InChI

InChI=1S/C7H9N3O3S/c8-4-3-5(11)10-7(9-4)14-2-1-6(12)13/h3H,1-2H2,(H,12,13)(H3,8,9,10,11)