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

Systemtic Name: 2-azanyl-3-[[2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]methylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[(2,4-dioxo-1H-pyrimidin-6-yl)methylsulfanyl]propanoic acid CAS Name: 2-amino-3-[(2,4-dioxo-1H-pyrimidin-6-yl)methylthio]propanoic acid IUPAC Name: 2-amino-3-[(2,4-dioxo-1H-pyrimidin-6-yl)methylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[(2,4-diketo-1H-pyrimidin-6-yl)methylthio]propionic acid Formula: C8H11N3O4S MolecularWeight: 245.25564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H11N3O4S/c9-5(7(13)14)3-16-2-4-1-6(12)11-8(15)10-4/h1,5H,2-3,9H2,(H,13,14)(H2,10,11,12,15)