2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]-N-nonyl-propanamide

Systemtic Name: 2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]-N-nonyl-propanamide Openeye Name: 2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]-N-nonyl-propanamide CAS Name: 2-[2-[(4-fluorophenyl)methylthio]-4-oxo-5-(5-pyrimidinylmethyl)-1-pyrimidinyl]-N-nonylpropanamide IUPAC Name: 2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]-N-nonylpropanamide Traditional Name: 2-[2-[(4-fluorobenzyl)thio]-4-keto-5-(5-pyrimidylmethyl)pyrimidin-1-yl]-N-nonyl-propionamide Formula: C28H36FN5O2S MolecularWeight: 525.681143

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCNC(=O)C(C)N1C=C(C(=O)N=C1SCC2=CC=C(C=C2)F)CC3=CN=CN=C3

Isomeric SMILES

CCCCCCCCCNC(=O)C(C)N1C=C(C(=O)N=C1SCC2=CC=C(C=C2)F)CC3=CN=CN=C3

InChI

InChI=1S/C28H36FN5O2S/c1-3-4-5-6-7-8-9-14-32-26(35)21(2)34-18-24(15-23-16-30-20-31-17-23)27(36)33-28(34)37-19-22-10-12-25(29)13-11-22/h10-13,16-18,20-21H,3-9,14-15,19H2,1-2H3,(H,32,35)