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

Systemtic Name: 2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-5-[(2-phenylmethoxypyrimidin-5-yl)methyl]pyrimidin-1-yl]-N-methyl-N-octyl-ethanamide Openeye Name: 2-[5-[(2-benzyloxypyrimidin-5-yl)methyl]-2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-pyrimidin-1-yl]-N-methyl-N-octyl-acetamide CAS Name: 2-[2-[(4-fluorophenyl)methylthio]-4-oxo-5-[(2-phenylmethoxy-5-pyrimidinyl)methyl]-1-pyrimidinyl]-N-methyl-N-octylacetamide IUPAC Name: 2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-5-[(2-phenylmethoxypyrimidin-5-yl)methyl]pyrimidin-1-yl]-N-methyl-N-octylacetamide Traditional Name: 2-[5-[(2-benzoxypyrimidin-5-yl)methyl]-2-[(4-fluorobenzyl)thio]-4-keto-pyrimidin-1-yl]-N-methyl-N-octyl-acetamide Formula: C34H40FN5O3S MolecularWeight: 617.776503

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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)OCC4=CC=CC=C4

Isomeric SMILES

CCCCCCCCN(C)C(=O)CN1C=C(C(=O)N=C1SCC2=CC=C(C=C2)F)CC3=CN=C(N=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C34H40FN5O3S/c1-3-4-5-6-7-11-18-39(2)31(41)23-40-22-29(32(42)38-34(40)44-25-27-14-16-30(35)17-15-27)19-28-20-36-33(37-21-28)43-24-26-12-9-8-10-13-26/h8-10,12-17,20-22H,3-7,11,18-19,23-25H2,1-2H3