5-(3-azanyl-2-phenyl-1-benzofuran-5-yl)-3-methyl-2-propyl-6-(trifluoromethylsulfonyl)pyrimidin-4-one

Systemtic Name: 5-(3-azanyl-2-phenyl-1-benzofuran-5-yl)-3-methyl-2-propyl-6-(trifluoromethylsulfonyl)pyrimidin-4-one Openeye Name: 5-(3-amino-2-phenyl-benzofuran-5-yl)-3-methyl-2-propyl-6-(trifluoromethylsulfonyl)pyrimidin-4-one CAS Name: 5-(3-amino-2-phenyl-5-benzofuranyl)-3-methyl-2-propyl-6-(trifluoromethylsulfonyl)-4-pyrimidinone IUPAC Name: 5-(3-amino-2-phenyl-1-benzofuran-5-yl)-3-methyl-2-propyl-6-(trifluoromethylsulfonyl)pyrimidin-4-one Traditional Name: 5-(3-amino-2-phenyl-benzofuran-5-yl)-3-methyl-2-propyl-6-triflyl-pyrimidin-4-one Formula: C23H20F3N3O4S MolecularWeight: 491.48281

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(C(=O)N1C)C2=CC3=C(C=C2)OC(=C3N)C4=CC=CC=C4)S(=O)(=O)C(F)(F)F

Isomeric SMILES

CCCC1=NC(=C(C(=O)N1C)C2=CC3=C(C=C2)OC(=C3N)C4=CC=CC=C4)S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C23H20F3N3O4S/c1-3-7-17-28-21(34(31,32)23(24,25)26)18(22(30)29(17)2)14-10-11-16-15(12-14)19(27)20(33-16)13-8-5-4-6-9-13/h4-6,8-12H,3,7,27H2,1-2H3