1-(3-chlorophenyl)-2-pyrimidin-2-ylsulfanyl-propan-1-one

Systemtic Name: 1-(3-chlorophenyl)-2-pyrimidin-2-ylsulfanyl-propan-1-one Openeye Name: 1-(3-chlorophenyl)-2-pyrimidin-2-ylsulfanyl-propan-1-one CAS Name: 1-(3-chlorophenyl)-2-(2-pyrimidinylthio)-1-propanone IUPAC Name: 1-(3-chlorophenyl)-2-pyrimidin-2-ylsulfanylpropan-1-one Traditional Name: 1-(3-chlorophenyl)-2-(2-pyrimidylthio)propan-1-one Formula: C13H11ClN2OS MolecularWeight: 278.75724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11ClN2OS/c1-9(18-13-15-6-3-7-16-13)12(17)10-4-2-5-11(14)8-10/h2-9H,1H3