1-[4-[4-[[8-cyclopentyl-5-methyl-7-(methylamino)quinazolin-2-yl]amino]phenyl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[4-[[8-cyclopentyl-5-methyl-7-(methylamino)quinazolin-2-yl]amino]phenyl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[4-[[8-cyclopentyl-5-methyl-7-(methylamino)quinazolin-2-yl]amino]phenyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[4-[[8-cyclopentyl-5-methyl-7-(methylamino)-2-quinazolinyl]amino]phenyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[4-[[8-cyclopentyl-5-methyl-7-(methylamino)quinazolin-2-yl]amino]phenyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[4-[[8-cyclopentyl-5-methyl-7-(methylamino)quinazolin-2-yl]amino]phenyl]piperazino]ethanone Formula: C27H34N6O MolecularWeight: 458.59846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=NC(=NC=C12)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)C)C5CCCC5)NC

Isomeric SMILES

CC1=CC(=C(C2=NC(=NC=C12)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)C)C5CCCC5)NC

InChI

InChI=1S/C27H34N6O/c1-18-16-24(28-3)25(20-6-4-5-7-20)26-23(18)17-29-27(31-26)30-21-8-10-22(11-9-21)33-14-12-32(13-15-33)19(2)34/h8-11,16-17,20,28H,4-7,12-15H2,1-3H3,(H,29,30,31)