3,6-dimethyl-2-phenacylsulfanyl-pyrimidin-4-one

Systemtic Name: 3,6-dimethyl-2-phenacylsulfanyl-pyrimidin-4-one Openeye Name: 3,6-dimethyl-2-phenacylsulfanyl-pyrimidin-4-one CAS Name: 3,6-dimethyl-2-(phenacylthio)-4-pyrimidinone IUPAC Name: 3,6-dimethyl-2-phenacylsulfanylpyrimidin-4-one Traditional Name: 3,6-dimethyl-2-(phenacylthio)pyrimidin-4-one Formula: C14H14N2O2S MolecularWeight: 274.33816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=N1)SCC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=O)N(C(=N1)SCC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C14H14N2O2S/c1-10-8-13(18)16(2)14(15-10)19-9-12(17)11-6-4-3-5-7-11/h3-8H,9H2,1-2H3