1-(4-methyl-2-phenyl-6-prop-2-enylsulfanyl-pyrimidin-5-yl)ethanone

Systemtic Name: 1-(4-methyl-2-phenyl-6-prop-2-enylsulfanyl-pyrimidin-5-yl)ethanone Openeye Name: 1-(4-allylsulfanyl-6-methyl-2-phenyl-pyrimidin-5-yl)ethanone CAS Name: 1-[4-methyl-2-phenyl-6-(prop-2-enylthio)-5-pyrimidinyl]ethanone IUPAC Name: 1-(4-methyl-2-phenyl-6-prop-2-enylsulfanylpyrimidin-5-yl)ethanone Traditional Name: 1-[4-(allylthio)-6-methyl-2-phenyl-pyrimidin-5-yl]ethanone Formula: C16H16N2OS MolecularWeight: 284.37604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2OS/c1-4-10-20-16-14(12(3)19)11(2)17-15(18-16)13-8-6-5-7-9-13/h4-9H,1,10H2,2-3H3