2-[5-[(2-ethoxypyrimidin-5-yl)methyl]-2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-pyrimidin-1-yl]-N-methyl-N-octyl-ethanamide

Systemtic Name: 2-[5-[(2-ethoxypyrimidin-5-yl)methyl]-2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-pyrimidin-1-yl]-N-methyl-N-octyl-ethanamide Openeye Name: 2-[5-[(2-ethoxypyrimidin-5-yl)methyl]-2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-pyrimidin-1-yl]-N-methyl-N-octyl-acetamide CAS Name: 2-[5-[(2-ethoxy-5-pyrimidinyl)methyl]-2-[(4-fluorophenyl)methylthio]-4-oxo-1-pyrimidinyl]-N-methyl-N-octylacetamide IUPAC Name: 2-[5-[(2-ethoxypyrimidin-5-yl)methyl]-2-[(4-fluorophenyl)methylsulfanyl]-4-oxopyrimidin-1-yl]-N-methyl-N-octylacetamide Traditional Name: 2-[5-[(2-ethoxypyrimidin-5-yl)methyl]-2-[(4-fluorobenzyl)thio]-4-keto-pyrimidin-1-yl]-N-methyl-N-octyl-acetamide Formula: C29H38FN5O3S MolecularWeight: 555.707123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(C)C(=O)CN1C=C(C(=O)N=C1SCC2=CC=C(C=C2)F)CC3=CN=C(N=C3)OCC

Isomeric SMILES

CCCCCCCCN(C)C(=O)CN1C=C(C(=O)N=C1SCC2=CC=C(C=C2)F)CC3=CN=C(N=C3)OCC

InChI

InChI=1S/C29H38FN5O3S/c1-4-6-7-8-9-10-15-34(3)26(36)20-35-19-24(16-23-17-31-28(32-18-23)38-5-2)27(37)33-29(35)39-21-22-11-13-25(30)14-12-22/h11-14,17-19H,4-10,15-16,20-21H2,1-3H3