N-methyl-N-[4-(2-pyrimidin-2-ylsulfanylethanoyl)phenyl]methanesulfonamide

Systemtic Name: N-methyl-N-[4-(2-pyrimidin-2-ylsulfanylethanoyl)phenyl]methanesulfonamide Openeye Name: N-methyl-N-[4-(2-pyrimidin-2-ylsulfanylacetyl)phenyl]methanesulfonamide CAS Name: N-methyl-N-[4-[1-oxo-2-(2-pyrimidinylthio)ethyl]phenyl]methanesulfonamide IUPAC Name: N-methyl-N-[4-(2-pyrimidin-2-ylsulfanylacetyl)phenyl]methanesulfonamide Traditional Name: N-methyl-N-[4-[2-(2-pyrimidylthio)acetyl]phenyl]methanesulfonamide Formula: C14H15N3O3S2 MolecularWeight: 337.4172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3O3S2/c1-17(22(2,19)20)12-6-4-11(5-7-12)13(18)10-21-14-15-8-3-9-16-14/h3-9H,10H2,1-2H3