N,N-dibutyl-2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]ethanamide

Systemtic Name: N,N-dibutyl-2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]ethanamide Openeye Name: N,N-dibutyl-2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]acetamide CAS Name: N,N-dibutyl-2-[2-[(4-fluorophenyl)methylthio]-4-oxo-5-(5-pyrimidinylmethyl)-1-pyrimidinyl]acetamide IUPAC Name: N,N-dibutyl-2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]acetamide Traditional Name: N,N-dibutyl-2-[2-[(4-fluorobenzyl)thio]-4-keto-5-(5-pyrimidylmethyl)pyrimidin-1-yl]acetamide Formula: C26H32FN5O2S MolecularWeight: 497.627983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)CN1C=C(C(=O)N=C1SCC2=CC=C(C=C2)F)CC3=CN=CN=C3

Isomeric SMILES

CCCCN(CCCC)C(=O)CN1C=C(C(=O)N=C1SCC2=CC=C(C=C2)F)CC3=CN=CN=C3

InChI

InChI=1S/C26H32FN5O2S/c1-3-5-11-31(12-6-4-2)24(33)17-32-16-22(13-21-14-28-19-29-15-21)25(34)30-26(32)35-18-20-7-9-23(27)10-8-20/h7-10,14-16,19H,3-6,11-13,17-18H2,1-2H3