1-[3-[(4-methoxyphenyl)methoxy]phenyl]-2-(2-methylsulfanylpyrimidin-4-yl)ethanone

Systemtic Name: 1-[3-[(4-methoxyphenyl)methoxy]phenyl]-2-(2-methylsulfanylpyrimidin-4-yl)ethanone Openeye Name: 1-[3-[(4-methoxyphenyl)methoxy]phenyl]-2-(2-methylsulfanylpyrimidin-4-yl)ethanone CAS Name: 1-[3-[(4-methoxyphenyl)methoxy]phenyl]-2-[2-(methylthio)-4-pyrimidinyl]ethanone IUPAC Name: 1-[3-[(4-methoxyphenyl)methoxy]phenyl]-2-(2-methylsulfanylpyrimidin-4-yl)ethanone Traditional Name: 2-[2-(methylthio)pyrimidin-4-yl]-1-(3-p-anisyloxyphenyl)ethanone Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)CC3=NC(=NC=C3)SC

Isomeric SMILES

COC1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)CC3=NC(=NC=C3)SC

InChI

InChI=1S/C21H20N2O3S/c1-25-18-8-6-15(7-9-18)14-26-19-5-3-4-16(12-19)20(24)13-17-10-11-22-21(23-17)27-2/h3-12H,13-14H2,1-2H3