N,N-dimethyl-3-(pyrimidin-2-ylsulfanylmethyl)benzenesulfonamide

Systemtic Name: N,N-dimethyl-3-(pyrimidin-2-ylsulfanylmethyl)benzenesulfonamide Openeye Name: N,N-dimethyl-3-(pyrimidin-2-ylsulfanylmethyl)benzenesulfonamide CAS Name: N,N-dimethyl-3-[(2-pyrimidinylthio)methyl]benzenesulfonamide IUPAC Name: N,N-dimethyl-3-(pyrimidin-2-ylsulfanylmethyl)benzenesulfonamide Traditional Name: N,N-dimethyl-3-[(2-pyrimidylthio)methyl]benzenesulfonamide Formula: C13H15N3O2S2 MolecularWeight: 309.4071

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)CSC2=NC=CC=N2

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)CSC2=NC=CC=N2

InChI

InChI=1S/C13H15N3O2S2/c1-16(2)20(17,18)12-6-3-5-11(9-12)10-19-13-14-7-4-8-15-13/h3-9H,10H2,1-2H3