2,3-dihydro-1H-indol-7-yl-[4-[[4-(quinolin-3-ylamino)pyrimidin-2-yl]amino]phenyl]methanone

Systemtic Name: 2,3-dihydro-1H-indol-7-yl-[4-[[4-(quinolin-3-ylamino)pyrimidin-2-yl]amino]phenyl]methanone Openeye Name: indolin-7-yl-[4-[[4-(3-quinolylamino)pyrimidin-2-yl]amino]phenyl]methanone CAS Name: 2,3-dihydro-1H-indol-7-yl-[4-[[4-(3-quinolinylamino)-2-pyrimidinyl]amino]phenyl]methanone IUPAC Name: 2,3-dihydro-1H-indol-7-yl-[4-[[4-(quinolin-3-ylamino)pyrimidin-2-yl]amino]phenyl]methanone Traditional Name: indolin-7-yl-[4-[[4-(3-quinolylamino)pyrimidin-2-yl]amino]phenyl]methanone Formula: C28H22N6O MolecularWeight: 458.51388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNC2=C(C=CC=C21)C(=O)C3=CC=C(C=C3)NC4=NC=CC(=N4)NC5=CC6=CC=CC=C6N=C5

Isomeric SMILES

C1CNC2=C(C=CC=C21)C(=O)C3=CC=C(C=C3)NC4=NC=CC(=N4)NC5=CC6=CC=CC=C6N=C5

InChI

InChI=1S/C28H22N6O/c35-27(23-6-3-5-18-12-14-29-26(18)23)19-8-10-21(11-9-19)33-28-30-15-13-25(34-28)32-22-16-20-4-1-2-7-24(20)31-17-22/h1-11,13,15-17,29H,12,14H2,(H2,30,32,33,34)