4-[4-methyl-7-oxidanylidene-2-[4-(2-phenylethanoyl)piperazin-1-yl]pyrido[2,3-d]pyrimidin-8-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide

Systemtic Name: 4-[4-methyl-7-oxidanylidene-2-[4-(2-phenylethanoyl)piperazin-1-yl]pyrido[2,3-d]pyrimidin-8-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide Openeye Name: 4-[4-methyl-7-oxo-2-[4-(2-phenylacetyl)piperazin-1-yl]pyrido[2,3-d]pyrimidin-8-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide CAS Name: 4-[4-methyl-7-oxo-2-[4-(1-oxo-2-phenylethyl)-1-piperazinyl]-8-pyrido[2,3-d]pyrimidinyl]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide IUPAC Name: 4-[4-methyl-7-oxo-2-[4-(2-phenylacetyl)piperazin-1-yl]pyrido[2,3-d]pyrimidin-8-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide Traditional Name: 4-[7-keto-4-methyl-2-[4-(2-phenylacetyl)piperazino]pyrido[2,3-d]pyrimidin-8-yl]-N-[4-(trifluoromethyl)benzyl]benzamide Formula: C35H31F3N6O3 MolecularWeight: 640.65425

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC(=O)N(C2=NC(=N1)N3CCN(CC3)C(=O)CC4=CC=CC=C4)C5=CC=C(C=C5)C(=O)NCC6=CC=C(C=C6)C(F)(F)F

Isomeric SMILES

CC1=C2C=CC(=O)N(C2=NC(=N1)N3CCN(CC3)C(=O)CC4=CC=CC=C4)C5=CC=C(C=C5)C(=O)NCC6=CC=C(C=C6)C(F)(F)F

InChI

InChI=1S/C35H31F3N6O3/c1-23-29-15-16-30(45)44(28-13-9-26(10-14-28)33(47)39-22-25-7-11-27(12-8-25)35(36,37)38)32(29)41-34(40-23)43-19-17-42(18-20-43)31(46)21-24-5-3-2-4-6-24/h2-16H,17-22H2,1H3,(H,39,47)