N-butyl-6-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]hexanamide

Systemtic Name: N-butyl-6-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]hexanamide Openeye Name: N-butyl-6-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]hexanamide CAS Name: N-butyl-6-[2-[(4-fluorophenyl)methylthio]-4-oxo-5-(5-pyrimidinylmethyl)-1-pyrimidinyl]hexanamide IUPAC Name: N-butyl-6-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]hexanamide Traditional Name: N-butyl-6-[2-[(4-fluorobenzyl)thio]-4-keto-5-(5-pyrimidylmethyl)pyrimidin-1-yl]hexanamide Formula: C26H32FN5O2S MolecularWeight: 497.627983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CCCCCN1C=C(C(=O)N=C1SCC2=CC=C(C=C2)F)CC3=CN=CN=C3

Isomeric SMILES

CCCCNC(=O)CCCCCN1C=C(C(=O)N=C1SCC2=CC=C(C=C2)F)CC3=CN=CN=C3

InChI

InChI=1S/C26H32FN5O2S/c1-2-3-12-30-24(33)7-5-4-6-13-32-17-22(14-21-15-28-19-29-16-21)25(34)31-26(32)35-18-20-8-10-23(27)11-9-20/h8-11,15-17,19H,2-7,12-14,18H2,1H3,(H,30,33)