5-(6-azanyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)pentanoic acid

Systemtic Name: 5-(6-azanyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)pentanoic acid Openeye Name: 5-(6-amino-4-oxo-2-thioxo-1H-pyrimidin-5-yl)pentanoic acid CAS Name: 5-(6-amino-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)pentanoic acid IUPAC Name: 5-(6-amino-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)pentanoic acid Traditional Name: 5-(6-amino-4-keto-2-thioxo-1H-pyrimidin-5-yl)valeric acid Formula: C9H13N3O3S MolecularWeight: 243.28282

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Descriptors Computed from Structure

Canonical SMILES:

C(CCC(=O)O)CC1=C(NC(=S)NC1=O)N

Isomeric SMILES

C(CCC(=O)O)CC1=C(NC(=S)NC1=O)N

InChI

InChI=1S/C9H13N3O3S/c10-7-5(3-1-2-4-6(13)14)8(15)12-9(16)11-7/h1-4H2,(H,13,14)(H4,10,11,12,15,16)