4-[6-(4-chlorophenyl)-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl]benzenesulfonamide

Systemtic Name: 4-[6-(4-chlorophenyl)-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl]benzenesulfonamide Openeye Name: 4-[6-(4-chlorophenyl)-4-oxo-2-thioxo-1H-pyrimidin-5-yl]benzenesulfonamide CAS Name: 4-[6-(4-chlorophenyl)-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl]benzenesulfonamide IUPAC Name: 4-[6-(4-chlorophenyl)-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl]benzenesulfonamide Traditional Name: 4-[6-(4-chlorophenyl)-4-keto-2-thioxo-1H-pyrimidin-5-yl]benzenesulfonamide Formula: C16H12ClN3O3S2 MolecularWeight: 393.86778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(NC(=S)NC2=O)C3=CC=C(C=C3)Cl)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1C2=C(NC(=S)NC2=O)C3=CC=C(C=C3)Cl)S(=O)(=O)N

InChI

InChI=1S/C16H12ClN3O3S2/c17-11-5-1-10(2-6-11)14-13(15(21)20-16(24)19-14)9-3-7-12(8-4-9)25(18,22)23/h1-8H,(H2,18,22,23)(H2,19,20,21,24)