2-azanyl-1-[4-[4-[(8-cyclopentyl-7-oxidanyl-5,8-dihydroquinazolin-2-yl)amino]phenyl]piperazin-1-yl]-3-methyl-butan-1-one

Systemtic Name: 2-azanyl-1-[4-[4-[(8-cyclopentyl-7-oxidanyl-5,8-dihydroquinazolin-2-yl)amino]phenyl]piperazin-1-yl]-3-methyl-butan-1-one Openeye Name: 2-amino-1-[4-[4-[(8-cyclopentyl-7-hydroxy-5,8-dihydroquinazolin-2-yl)amino]phenyl]piperazin-1-yl]-3-methyl-butan-1-one CAS Name: 2-amino-1-[4-[4-[(8-cyclopentyl-7-hydroxy-5,8-dihydroquinazolin-2-yl)amino]phenyl]-1-piperazinyl]-3-methyl-1-butanone IUPAC Name: 2-amino-1-[4-[4-[(8-cyclopentyl-7-hydroxy-5,8-dihydroquinazolin-2-yl)amino]phenyl]piperazin-1-yl]-3-methylbutan-1-one Traditional Name: 2-amino-1-[4-[4-[(8-cyclopentyl-7-hydroxy-5,8-dihydroquinazolin-2-yl)amino]phenyl]piperazino]-3-methyl-butan-1-one Formula: C28H38N6O2 MolecularWeight: 490.64032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C4CC=C(C(C4=N3)C5CCCC5)O)N

Isomeric SMILES

CC(C)C(C(=O)N1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C4CC=C(C(C4=N3)C5CCCC5)O)N

InChI

InChI=1S/C28H38N6O2/c1-18(2)25(29)27(36)34-15-13-33(14-16-34)22-10-8-21(9-11-22)31-28-30-17-20-7-12-23(35)24(26(20)32-28)19-5-3-4-6-19/h8-12,17-19,24-25,35H,3-7,13-16,29H2,1-2H3,(H,30,31,32)