N-dodecyl-2-[2-[(4-fluorophenyl)methylsulfanyl]-5-[(2-methoxypyrimidin-5-yl)methyl]-4-oxidanylidene-1H-pyrimidin-6-yl]-N-methyl-ethanamide

Systemtic Name: N-dodecyl-2-[2-[(4-fluorophenyl)methylsulfanyl]-5-[(2-methoxypyrimidin-5-yl)methyl]-4-oxidanylidene-1H-pyrimidin-6-yl]-N-methyl-ethanamide Openeye Name: N-dodecyl-2-[2-[(4-fluorophenyl)methylsulfanyl]-5-[(2-methoxypyrimidin-5-yl)methyl]-4-oxo-1H-pyrimidin-6-yl]-N-methyl-acetamide CAS Name: N-dodecyl-2-[2-[(4-fluorophenyl)methylthio]-5-[(2-methoxy-5-pyrimidinyl)methyl]-4-oxo-1H-pyrimidin-6-yl]-N-methylacetamide IUPAC Name: N-dodecyl-2-[2-[(4-fluorophenyl)methylsulfanyl]-5-[(2-methoxypyrimidin-5-yl)methyl]-4-oxo-1H-pyrimidin-6-yl]-N-methylacetamide Traditional Name: 2-[2-[(4-fluorobenzyl)thio]-4-keto-5-[(2-methoxypyrimidin-5-yl)methyl]-1H-pyrimidin-6-yl]-N-lauryl-N-methyl-acetamide Formula: C32H44FN5O3S MolecularWeight: 597.786863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN(C)C(=O)CC1=C(C(=O)N=C(N1)SCC2=CC=C(C=C2)F)CC3=CN=C(N=C3)OC

Isomeric SMILES

CCCCCCCCCCCCN(C)C(=O)CC1=C(C(=O)N=C(N1)SCC2=CC=C(C=C2)F)CC3=CN=C(N=C3)OC

InChI

InChI=1S/C32H44FN5O3S/c1-4-5-6-7-8-9-10-11-12-13-18-38(2)29(39)20-28-27(19-25-21-34-31(41-3)35-22-25)30(40)37-32(36-28)42-23-24-14-16-26(33)17-15-24/h14-17,21-22H,4-13,18-20,23H2,1-3H3,(H,36,37,40)