2-(4-aminocarbonyl-2-nitro-phenyl)sulfanylpyrimidin-4-olate

Systemtic Name: 2-(4-aminocarbonyl-2-nitro-phenyl)sulfanylpyrimidin-4-olate Openeye Name: 2-(4-carbamoyl-2-nitro-phenyl)sulfanylpyrimidin-4-olate CAS Name: 2-[(4-carbamoyl-2-nitrophenyl)thio]-4-pyrimidinolate IUPAC Name: 2-(4-carbamoyl-2-nitrophenyl)sulfanylpyrimidin-4-olate Traditional Name: 2-[(4-carbamoyl-2-nitro-phenyl)thio]pyrimidin-4-olate Formula: C11H7N4O4S- MolecularWeight: 291.26268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])SC2=NC=CC(=N2)[O-]

Isomeric SMILES

C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])SC2=NC=CC(=N2)[O-]

InChI

InChI=1S/C11H8N4O4S/c12-10(17)6-1-2-8(7(5-6)15(18)19)20-11-13-4-3-9(16)14-11/h1-5H,(H2,12,17)(H,13,14,16)/p-1