6-ethyl-2-[(2-fluorophenyl)methylsulfanyl]-3-methyl-5-[(3-methylphenyl)methyl]pyrimidin-4-one

Systemtic Name: 6-ethyl-2-[(2-fluorophenyl)methylsulfanyl]-3-methyl-5-[(3-methylphenyl)methyl]pyrimidin-4-one Openeye Name: 6-ethyl-2-[(2-fluorophenyl)methylsulfanyl]-3-methyl-5-(m-tolylmethyl)pyrimidin-4-one CAS Name: 6-ethyl-2-[(2-fluorophenyl)methylthio]-3-methyl-5-[(3-methylphenyl)methyl]-4-pyrimidinone IUPAC Name: 6-ethyl-2-[(2-fluorophenyl)methylsulfanyl]-3-methyl-5-[(3-methylphenyl)methyl]pyrimidin-4-one Traditional Name: 6-ethyl-2-[(2-fluorobenzyl)thio]-3-methyl-5-(3-methylbenzyl)pyrimidin-4-one Formula: C22H23FN2OS MolecularWeight: 382.494223

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)N(C(=N1)SCC2=CC=CC=C2F)C)CC3=CC=CC(=C3)C

Isomeric SMILES

CCC1=C(C(=O)N(C(=N1)SCC2=CC=CC=C2F)C)CC3=CC=CC(=C3)C

InChI

InChI=1S/C22H23FN2OS/c1-4-20-18(13-16-9-7-8-15(2)12-16)21(26)25(3)22(24-20)27-14-17-10-5-6-11-19(17)23/h5-12H,4,13-14H2,1-3H3