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

Systemtic Name: 2-[[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methylamino]-5-nitro-phenolate Openeye Name: 2-[(4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene)methylamino]-5-nitro-phenolate CAS Name: 2-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methylamino]-5-nitrophenolate IUPAC Name: 2-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methylamino]-5-nitrophenolate Traditional Name: 2-[(4,6-diketo-2-thioxo-hexahydropyrimidin-5-ylidene)methylamino]-5-nitro-phenolate Formula: C11H7N4O5S- MolecularWeight: 307.26208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])[O-])NC=C2C(=O)NC(=S)NC2=O

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])[O-])NC=C2C(=O)NC(=S)NC2=O

InChI

InChI=1S/C11H8N4O5S/c16-8-3-5(15(19)20)1-2-7(8)12-4-6-9(17)13-11(21)14-10(6)18/h1-4,12,16H,(H2,13,14,17,18,21)/p-1