4-[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-yl]butanoic acid

Systemtic Name: 4-[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-yl]butanoic acid Openeye Name: 4-(4,6-dioxo-2-thioxo-hexahydropyrimidin-5-yl)butanoic acid CAS Name: 4-(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-yl)butanoic acid IUPAC Name: 4-(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-yl)butanoic acid Traditional Name: 4-(4,6-diketo-2-thioxo-hexahydropyrimidin-5-yl)butyric acid Formula: C8H10N2O4S MolecularWeight: 230.241

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Descriptors Computed from Structure

Canonical SMILES:

C(CC1C(=O)NC(=S)NC1=O)CC(=O)O

Isomeric SMILES

C(CC1C(=O)NC(=S)NC1=O)CC(=O)O

InChI

InChI=1S/C8H10N2O4S/c11-5(12)3-1-2-4-6(13)9-8(15)10-7(4)14/h4H,1-3H2,(H,11,12)(H2,9,10,13,14,15)