N-(2-pyrimidin-2-ylsulfanylpropyl)benzenesulfonamide

Systemtic Name: N-(2-pyrimidin-2-ylsulfanylpropyl)benzenesulfonamide Openeye Name: N-(2-pyrimidin-2-ylsulfanylpropyl)benzenesulfonamide CAS Name: N-[2-(2-pyrimidinylthio)propyl]benzenesulfonamide IUPAC Name: N-(2-pyrimidin-2-ylsulfanylpropyl)benzenesulfonamide Traditional Name: N-[2-(2-pyrimidylthio)propyl]benzenesulfonamide Formula: C13H15N3O2S2 MolecularWeight: 309.4071

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNS(=O)(=O)C1=CC=CC=C1)SC2=NC=CC=N2

Isomeric SMILES

CC(CNS(=O)(=O)C1=CC=CC=C1)SC2=NC=CC=N2

InChI

InChI=1S/C13H15N3O2S2/c1-11(19-13-14-8-5-9-15-13)10-16-20(17,18)12-6-3-2-4-7-12/h2-9,11,16H,10H2,1H3