2-[2-(4-methylphenyl)sulfonylethylsulfanyl]pyrimidine

Systemtic Name: 2-[2-(4-methylphenyl)sulfonylethylsulfanyl]pyrimidine Openeye Name: 2-[2-(p-tolylsulfonyl)ethylsulfanyl]pyrimidine CAS Name: 2-[2-(4-methylphenyl)sulfonylethylthio]pyrimidine IUPAC Name: 2-[2-(4-methylphenyl)sulfonylethylsulfanyl]pyrimidine Traditional Name: 2-(2-tosylethylthio)pyrimidine Formula: C13H14N2O2S2 MolecularWeight: 294.39246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCSC2=NC=CC=N2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCSC2=NC=CC=N2

InChI

InChI=1S/C13H14N2O2S2/c1-11-3-5-12(6-4-11)19(16,17)10-9-18-13-14-7-2-8-15-13/h2-8H,9-10H2,1H3