4-oxidanylidene-4-[(2-sulfanylidene-1H-pyrimidin-6-yl)amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[(2-sulfanylidene-1H-pyrimidin-6-yl)amino]butanoic acid Openeye Name: 4-oxo-4-[(2-thioxo-1H-pyrimidin-6-yl)amino]butanoic acid CAS Name: 4-oxo-4-[(2-sulfanylidene-1H-pyrimidin-6-yl)amino]butanoic acid IUPAC Name: 4-oxo-4-[(2-sulfanylidene-1H-pyrimidin-6-yl)amino]butanoic acid Traditional Name: 4-keto-4-[(2-thioxo-1H-pyrimidin-6-yl)amino]butyric acid Formula: C8H9N3O3S MolecularWeight: 227.24036

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC(=S)N=C1)NC(=O)CCC(=O)O

Isomeric SMILES

C1=C(NC(=S)N=C1)NC(=O)CCC(=O)O

InChI

InChI=1S/C8H9N3O3S/c12-6(1-2-7(13)14)10-5-3-4-9-8(15)11-5/h3-4H,1-2H2,(H,13,14)(H2,9,10,11,12,15)