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

Systemtic Name: 2-[(4-fluorophenyl)methylsulfanyl]-1-(4-morpholin-4-ylcarbonylphenyl)-5-(pyrimidin-5-ylmethyl)pyrimidin-4-one Openeye Name: 2-[(4-fluorophenyl)methylsulfanyl]-1-[4-(morpholine-4-carbonyl)phenyl]-5-(pyrimidin-5-ylmethyl)pyrimidin-4-one CAS Name: 2-[(4-fluorophenyl)methylthio]-1-[4-[4-morpholinyl(oxo)methyl]phenyl]-5-(5-pyrimidinylmethyl)-4-pyrimidinone IUPAC Name: 2-[(4-fluorophenyl)methylsulfanyl]-1-[4-(morpholine-4-carbonyl)phenyl]-5-(pyrimidin-5-ylmethyl)pyrimidin-4-one Traditional Name: 2-[(4-fluorobenzyl)thio]-1-[4-(morpholine-4-carbonyl)phenyl]-5-(5-pyrimidylmethyl)pyrimidin-4-one Formula: C27H24FN5O3S MolecularWeight: 517.574563

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2=CC=C(C=C2)N3C=C(C(=O)N=C3SCC4=CC=C(C=C4)F)CC5=CN=CN=C5

Isomeric SMILES

C1COCCN1C(=O)C2=CC=C(C=C2)N3C=C(C(=O)N=C3SCC4=CC=C(C=C4)F)CC5=CN=CN=C5

InChI

InChI=1S/C27H24FN5O3S/c28-23-5-1-19(2-6-23)17-37-27-31-25(34)22(13-20-14-29-18-30-15-20)16-33(27)24-7-3-21(4-8-24)26(35)32-9-11-36-12-10-32/h1-8,14-16,18H,9-13,17H2