3-[[2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]methylsulfanyl]propanoic acid

Systemtic Name: 3-[[2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]methylsulfanyl]propanoic acid Openeye Name: 3-[(2,4-dioxo-1H-pyrimidin-6-yl)methylsulfanyl]propanoic acid CAS Name: 3-[(2,4-dioxo-1H-pyrimidin-6-yl)methylthio]propanoic acid IUPAC Name: 3-[(2,4-dioxo-1H-pyrimidin-6-yl)methylsulfanyl]propanoic acid Traditional Name: 3-[(2,4-diketo-1H-pyrimidin-6-yl)methylthio]propionic acid Formula: C8H10N2O4S MolecularWeight: 230.241

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC(=O)NC1=O)CSCCC(=O)O

Isomeric SMILES

C1=C(NC(=O)NC1=O)CSCCC(=O)O

InChI

InChI=1S/C8H10N2O4S/c11-6-3-5(9-8(14)10-6)4-15-2-1-7(12)13/h3H,1-2,4H2,(H,12,13)(H2,9,10,11,14)