sodium 5-[[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]furan-2-sulfonate

Systemtic Name: sodium 5-[[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]furan-2-sulfonate Openeye Name: sodium 5-[(4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene)methyl]furan-2-sulfonate CAS Name: sodium 5-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]-2-furansulfonate IUPAC Name: sodium 5-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]furan-2-sulfonate Traditional Name: sodium 5-[(4,6-diketo-2-thioxo-hexahydropyrimidin-5-ylidene)methyl]furan-2-sulfonate Formula: C9H5N2NaO6S2 MolecularWeight: 324.26557

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC(=C1)S(=O)(=O)[O-])C=C2C(=O)NC(=S)NC2=O.[Na+]

Isomeric SMILES

C1=C(OC(=C1)S(=O)(=O)[O-])C=C2C(=O)NC(=S)NC2=O.[Na+]

InChI

InChI=1S/C9H6N2O6S2.Na/c12-7-5(8(13)11-9(18)10-7)3-4-1-2-6(17-4)19(14,15)16;/h1-3H,(H,14,15,16)(H2,10,11,12,13,18);/q;+1/p-1