[4-[[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]sulfonylamino]phenyl] thiocyanate

Systemtic Name: [4-[[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]sulfonylamino]phenyl] thiocyanate Openeye Name: [4-[(2,4-dioxo-1H-pyrimidin-5-yl)sulfonylamino]phenyl] thiocyanate CAS Name: thiocyanic acid [4-[(2,4-dioxo-1H-pyrimidin-5-yl)sulfonylamino]phenyl] ester IUPAC Name: [4-[(2,4-dioxo-1H-pyrimidin-5-yl)sulfonylamino]phenyl] thiocyanate Traditional Name: thiocyanic acid [4-[(2,4-diketo-1H-pyrimidin-5-yl)sulfonylamino]phenyl] ester Formula: C11H8N4O4S2 MolecularWeight: 324.33562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NS(=O)(=O)C2=CNC(=O)NC2=O)SC#N

Isomeric SMILES

C1=CC(=CC=C1NS(=O)(=O)C2=CNC(=O)NC2=O)SC#N

InChI

InChI=1S/C11H8N4O4S2/c12-6-20-8-3-1-7(2-4-8)15-21(18,19)9-5-13-11(17)14-10(9)16/h1-5,15H,(H2,13,14,16,17)