1-ethyl-2-[(4-fluorophenyl)methylsulfanyl]-5-(pyrimidin-5-ylmethyl)pyrimidin-4-one

Systemtic Name: 1-ethyl-2-[(4-fluorophenyl)methylsulfanyl]-5-(pyrimidin-5-ylmethyl)pyrimidin-4-one Openeye Name: 1-ethyl-2-[(4-fluorophenyl)methylsulfanyl]-5-(pyrimidin-5-ylmethyl)pyrimidin-4-one CAS Name: 1-ethyl-2-[(4-fluorophenyl)methylthio]-5-(5-pyrimidinylmethyl)-4-pyrimidinone IUPAC Name: 1-ethyl-2-[(4-fluorophenyl)methylsulfanyl]-5-(pyrimidin-5-ylmethyl)pyrimidin-4-one Traditional Name: 1-ethyl-2-[(4-fluorobenzyl)thio]-5-(5-pyrimidylmethyl)pyrimidin-4-one Formula: C18H17FN4OS MolecularWeight: 356.417183

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)N=C1SCC2=CC=C(C=C2)F)CC3=CN=CN=C3

Isomeric SMILES

CCN1C=C(C(=O)N=C1SCC2=CC=C(C=C2)F)CC3=CN=CN=C3

InChI

InChI=1S/C18H17FN4OS/c1-2-23-10-15(7-14-8-20-12-21-9-14)17(24)22-18(23)25-11-13-3-5-16(19)6-4-13/h3-6,8-10,12H,2,7,11H2,1H3