1-[4,6-bis(methylsulfanyl)-2-phenyl-pyrimidin-5-yl]ethanone

Systemtic Name: 1-[4,6-bis(methylsulfanyl)-2-phenyl-pyrimidin-5-yl]ethanone Openeye Name: 1-[4,6-bis(methylsulfanyl)-2-phenyl-pyrimidin-5-yl]ethanone CAS Name: 1-[4,6-bis(methylthio)-2-phenyl-5-pyrimidinyl]ethanone IUPAC Name: 1-[4,6-bis(methylsulfanyl)-2-phenylpyrimidin-5-yl]ethanone Traditional Name: 1-[4,6-bis(methylthio)-2-phenyl-pyrimidin-5-yl]ethanone Formula: C14H14N2OS2 MolecularWeight: 290.40376

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N=C(N=C1SC)C2=CC=CC=C2)SC

Isomeric SMILES

CC(=O)C1=C(N=C(N=C1SC)C2=CC=CC=C2)SC

InChI

InChI=1S/C14H14N2OS2/c1-9(17)11-13(18-2)15-12(16-14(11)19-3)10-7-5-4-6-8-10/h4-8H,1-3H3