2-[5-oxidanylidene-3-[4-(4-oxidanylidene-2-sulfanylidene-1,3-diazinan-1-yl)phenyl]-2-sulfanylidene-imidazolidin-4-yl]ethanoic acid

Systemtic Name: 2-[5-oxidanylidene-3-[4-(4-oxidanylidene-2-sulfanylidene-1,3-diazinan-1-yl)phenyl]-2-sulfanylidene-imidazolidin-4-yl]ethanoic acid Openeye Name: 2-[5-oxo-3-[4-(4-oxo-2-thioxo-hexahydropyrimidin-1-yl)phenyl]-2-thioxo-imidazolidin-4-yl]acetic acid CAS Name: 2-[5-oxo-3-[4-(4-oxo-2-sulfanylidene-1,3-diazinan-1-yl)phenyl]-2-sulfanylidene-4-imidazolidinyl]acetic acid IUPAC Name: 2-[5-oxo-3-[4-(4-oxo-2-sulfanylidene-1,3-diazinan-1-yl)phenyl]-2-sulfanylideneimidazolidin-4-yl]acetic acid Traditional Name: 2-[5-keto-3-[4-(4-keto-2-thioxo-hexahydropyrimidin-1-yl)phenyl]-2-thioxo-imidazolidin-4-yl]acetic acid Formula: C15H14N4O4S2 MolecularWeight: 378.42606

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=S)NC1=O)C2=CC=C(C=C2)N3C(C(=O)NC3=S)CC(=O)O

Isomeric SMILES

C1CN(C(=S)NC1=O)C2=CC=C(C=C2)N3C(C(=O)NC3=S)CC(=O)O

InChI

InChI=1S/C15H14N4O4S2/c20-11-5-6-18(14(24)16-11)8-1-3-9(4-2-8)19-10(7-12(21)22)13(23)17-15(19)25/h1-4,10H,5-7H2,(H,21,22)(H,16,20,24)(H,17,23,25)