5-(4-fluoranylphenoxy)-3,6-dimethyl-2-[(4-methylphenyl)methylsulfanyl]pyrimidin-4-one

Systemtic Name: 5-(4-fluoranylphenoxy)-3,6-dimethyl-2-[(4-methylphenyl)methylsulfanyl]pyrimidin-4-one Openeye Name: 5-(4-fluorophenoxy)-3,6-dimethyl-2-(p-tolylmethylsulfanyl)pyrimidin-4-one CAS Name: 5-(4-fluorophenoxy)-3,6-dimethyl-2-[(4-methylphenyl)methylthio]-4-pyrimidinone IUPAC Name: 5-(4-fluorophenoxy)-3,6-dimethyl-2-[(4-methylphenyl)methylsulfanyl]pyrimidin-4-one Traditional Name: 5-(4-fluorophenoxy)-3,6-dimethyl-2-[(4-methylbenzyl)thio]pyrimidin-4-one Formula: C20H19FN2O2S MolecularWeight: 370.440463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC(=C(C(=O)N2C)OC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC(=C(C(=O)N2C)OC3=CC=C(C=C3)F)C

InChI

InChI=1S/C20H19FN2O2S/c1-13-4-6-15(7-5-13)12-26-20-22-14(2)18(19(24)23(20)3)25-17-10-8-16(21)9-11-17/h4-11H,12H2,1-3H3