N-[4-(2-pyrimidin-2-ylsulfanylpropanoyl)phenyl]methanesulfonamide

Systemtic Name: N-[4-(2-pyrimidin-2-ylsulfanylpropanoyl)phenyl]methanesulfonamide Openeye Name: N-[4-(2-pyrimidin-2-ylsulfanylpropanoyl)phenyl]methanesulfonamide CAS Name: N-[4-[1-oxo-2-(2-pyrimidinylthio)propyl]phenyl]methanesulfonamide IUPAC Name: N-[4-(2-pyrimidin-2-ylsulfanylpropanoyl)phenyl]methanesulfonamide Traditional Name: N-[4-[2-(2-pyrimidylthio)propanoyl]phenyl]methanesulfonamide Formula: C14H15N3O3S2 MolecularWeight: 337.4172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)NS(=O)(=O)C)SC2=NC=CC=N2

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)NS(=O)(=O)C)SC2=NC=CC=N2

InChI

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