2-azanyl-3-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)propanoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC(=S)NC1=O)CC(C(=O)O)N

Isomeric SMILES

C1=C(NC(=S)NC1=O)CC(C(=O)O)N

InChI

InChI=1S/C7H9N3O3S/c8-4(6(12)13)1-3-2-5(11)10-7(14)9-3/h2,4H,1,8H2,(H,12,13)(H2,9,10,11,14)