4-[2-(6-azanyl-4-oxidanylidene-2-sulfanylidene-pyrimidin-1-yl)ethyl]benzenesulfonamide

Systemtic Name: 4-[2-(6-azanyl-4-oxidanylidene-2-sulfanylidene-pyrimidin-1-yl)ethyl]benzenesulfonamide Openeye Name: 4-[2-(6-amino-4-oxo-2-thioxo-pyrimidin-1-yl)ethyl]benzenesulfonamide CAS Name: 4-[2-(6-amino-4-oxo-2-sulfanylidene-1-pyrimidinyl)ethyl]benzenesulfonamide IUPAC Name: 4-[2-(6-amino-4-oxo-2-sulfanylidenepyrimidin-1-yl)ethyl]benzenesulfonamide Traditional Name: 4-[2-(6-amino-4-keto-2-thioxo-pyrimidin-1-yl)ethyl]benzenesulfonamide Formula: C12H14N4O3S2 MolecularWeight: 326.39456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCN2C(=CC(=O)NC2=S)N)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1CCN2C(=CC(=O)NC2=S)N)S(=O)(=O)N

InChI

InChI=1S/C12H14N4O3S2/c13-10-7-11(17)15-12(20)16(10)6-5-8-1-3-9(4-2-8)21(14,18)19/h1-4,7H,5-6,13H2,(H2,14,18,19)(H,15,17,20)