2-[5-[[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]furan-2-yl]-4-nitro-phenolate

Systemtic Name: 2-[5-[[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]furan-2-yl]-4-nitro-phenolate Openeye Name: 2-[5-[(4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene)methyl]-2-furyl]-4-nitro-phenolate CAS Name: 2-[5-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]-2-furanyl]-4-nitrophenolate IUPAC Name: 2-[5-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]furan-2-yl]-4-nitrophenolate Traditional Name: 2-[5-[(4,6-diketo-2-thioxo-hexahydropyrimidin-5-ylidene)methyl]-2-furyl]-4-nitro-phenolate Formula: C15H8N3O6S- MolecularWeight: 358.30552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C2=CC=C(O2)C=C3C(=O)NC(=S)NC3=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C2=CC=C(O2)C=C3C(=O)NC(=S)NC3=O)[O-]

InChI

InChI=1S/C15H9N3O6S/c19-11-3-1-7(18(22)23)5-9(11)12-4-2-8(24-12)6-10-13(20)16-15(25)17-14(10)21/h1-6,19H,(H2,16,17,20,21,25)/p-1