tert-butyl 4-[4-[(7-methoxy-8-propan-2-yl-quinazolin-2-yl)amino]phenyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(7-methoxy-8-propan-2-yl-quinazolin-2-yl)amino]phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(8-isopropyl-7-methoxy-quinazolin-2-yl)amino]phenyl]piperazine-1-carboxylate CAS Name: 4-[4-[(7-methoxy-8-propan-2-yl-2-quinazolinyl)amino]phenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(7-methoxy-8-propan-2-ylquinazolin-2-yl)amino]phenyl]piperazine-1-carboxylate Traditional Name: 4-[4-[(8-isopropyl-7-methoxy-quinazolin-2-yl)amino]phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C27H35N5O3 MolecularWeight: 477.5985

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC2=CN=C(N=C21)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)OC(C)(C)C)OC

Isomeric SMILES

CC(C)C1=C(C=CC2=CN=C(N=C21)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)OC(C)(C)C)OC

InChI

InChI=1S/C27H35N5O3/c1-18(2)23-22(34-6)12-7-19-17-28-25(30-24(19)23)29-20-8-10-21(11-9-20)31-13-15-32(16-14-31)26(33)35-27(3,4)5/h7-12,17-18H,13-16H2,1-6H3,(H,28,29,30)