4-[2-(5-azanyl-6-oxidanylidene-2-phenyl-pyrimidin-1-yl)ethanoylamino]-2,2-bis(fluoranyl)-5-methyl-3-oxidanylidene-N-phenethyl-hexanamide

Systemtic Name: 4-[2-(5-azanyl-6-oxidanylidene-2-phenyl-pyrimidin-1-yl)ethanoylamino]-2,2-bis(fluoranyl)-5-methyl-3-oxidanylidene-N-phenethyl-hexanamide Openeye Name: 4-[[2-(5-amino-6-oxo-2-phenyl-pyrimidin-1-yl)acetyl]amino]-2,2-difluoro-5-methyl-3-oxo-N-phenethyl-hexanamide CAS Name: 4-[[2-(5-amino-6-oxo-2-phenyl-1-pyrimidinyl)-1-oxoethyl]amino]-2,2-difluoro-5-methyl-3-oxo-N-phenethylhexanamide IUPAC Name: 4-[[2-(5-amino-6-oxo-2-phenylpyrimidin-1-yl)acetyl]amino]-2,2-difluoro-5-methyl-3-oxo-N-phenethylhexanamide Traditional Name: 4-[[2-(5-amino-6-keto-2-phenyl-pyrimidin-1-yl)acetyl]amino]-2,2-difluoro-3-keto-5-methyl-N-phenethyl-hexanamide Formula: C27H29F2N5O4 MolecularWeight: 525.547066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)C(C(=O)NCCC1=CC=CC=C1)(F)F)NC(=O)CN2C(=NC=C(C2=O)N)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)C(C(=O)NCCC1=CC=CC=C1)(F)F)NC(=O)CN2C(=NC=C(C2=O)N)C3=CC=CC=C3

InChI

InChI=1S/C27H29F2N5O4/c1-17(2)22(23(36)27(28,29)26(38)31-14-13-18-9-5-3-6-10-18)33-21(35)16-34-24(19-11-7-4-8-12-19)32-15-20(30)25(34)37/h3-12,15,17,22H,13-14,16,30H2,1-2H3,(H,31,38)(H,33,35)