1-[4-[4-[[8-cyclopentyl-7-(methylamino)quinazolin-2-yl]amino]phenyl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[4-[[8-cyclopentyl-7-(methylamino)quinazolin-2-yl]amino]phenyl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[4-[[8-cyclopentyl-7-(methylamino)quinazolin-2-yl]amino]phenyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[4-[[8-cyclopentyl-7-(methylamino)-2-quinazolinyl]amino]phenyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[4-[[8-cyclopentyl-7-(methylamino)quinazolin-2-yl]amino]phenyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[4-[[8-cyclopentyl-7-(methylamino)quinazolin-2-yl]amino]phenyl]piperazino]ethanone Formula: C26H32N6O MolecularWeight: 444.57188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C4C=CC(=C(C4=N3)C5CCCC5)NC

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C4C=CC(=C(C4=N3)C5CCCC5)NC

InChI

InChI=1S/C26H32N6O/c1-18(33)31-13-15-32(16-14-31)22-10-8-21(9-11-22)29-26-28-17-20-7-12-23(27-2)24(25(20)30-26)19-5-3-4-6-19/h7-12,17,19,27H,3-6,13-16H2,1-2H3,(H,28,29,30)