4-chloranyl-N-(2-phenyl-2-pyrimidin-2-ylsulfanyl-ethyl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(2-phenyl-2-pyrimidin-2-ylsulfanyl-ethyl)benzenesulfonamide Openeye Name: 4-chloro-N-(2-phenyl-2-pyrimidin-2-ylsulfanyl-ethyl)benzenesulfonamide CAS Name: 4-chloro-N-[2-phenyl-2-(2-pyrimidinylthio)ethyl]benzenesulfonamide IUPAC Name: 4-chloro-N-(2-phenyl-2-pyrimidin-2-ylsulfanylethyl)benzenesulfonamide Traditional Name: 4-chloro-N-[2-phenyl-2-(2-pyrimidylthio)ethyl]benzenesulfonamide Formula: C18H16ClN3O2S2 MolecularWeight: 405.92154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC=C(C=C2)Cl)SC3=NC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC=C(C=C2)Cl)SC3=NC=CC=N3

InChI

InChI=1S/C18H16ClN3O2S2/c19-15-7-9-16(10-8-15)26(23,24)22-13-17(14-5-2-1-3-6-14)25-18-20-11-4-12-21-18/h1-12,17,22H,13H2