1-[[4-[2-[[(4-methylphthalazin-1-yl)amino]methyl]phenyl]phenyl]methyl]pyrrolidin-2-one

Systemtic Name: 1-[[4-[2-[[(4-methylphthalazin-1-yl)amino]methyl]phenyl]phenyl]methyl]pyrrolidin-2-one Openeye Name: 1-[[4-[2-[[(4-methylphthalazin-1-yl)amino]methyl]phenyl]phenyl]methyl]pyrrolidin-2-one CAS Name: 1-[[4-[2-[[(4-methyl-1-phthalazinyl)amino]methyl]phenyl]phenyl]methyl]-2-pyrrolidinone IUPAC Name: 1-[[4-[2-[[(4-methylphthalazin-1-yl)amino]methyl]phenyl]phenyl]methyl]pyrrolidin-2-one Traditional Name: 1-[4-[2-[[(4-methylphthalazin-1-yl)amino]methyl]phenyl]benzyl]-2-pyrrolidone Formula: C27H26N4O MolecularWeight: 422.52154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(C2=CC=CC=C12)NCC3=CC=CC=C3C4=CC=C(C=C4)CN5CCCC5=O

Isomeric SMILES

CC1=NN=C(C2=CC=CC=C12)NCC3=CC=CC=C3C4=CC=C(C=C4)CN5CCCC5=O

InChI

InChI=1S/C27H26N4O/c1-19-23-8-4-5-10-25(23)27(30-29-19)28-17-22-7-2-3-9-24(22)21-14-12-20(13-15-21)18-31-16-6-11-26(31)32/h2-5,7-10,12-15H,6,11,16-18H2,1H3,(H,28,30)