2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]-6-phenyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]-6-phenyl-1H-pyrimidin-4-one Openeye Name: 2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]-6-phenyl-1H-pyrimidin-4-one CAS Name: 2-[2-(3,4-dimethylphenoxy)ethylthio]-6-phenyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]-6-phenyl-1H-pyrimidin-4-one Traditional Name: 2-[2-(3,4-dimethylphenoxy)ethylthio]-6-phenyl-1H-pyrimidin-4-one Formula: C20H20N2O2S MolecularWeight: 352.45

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCCSC2=NC(=O)C=C(N2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCCSC2=NC(=O)C=C(N2)C3=CC=CC=C3)C

InChI

InChI=1S/C20H20N2O2S/c1-14-8-9-17(12-15(14)2)24-10-11-25-20-21-18(13-19(23)22-20)16-6-4-3-5-7-16/h3-9,12-13H,10-11H2,1-2H3,(H,21,22,23)