tert-butyl 4-(2-pyridin-4-ylquinazolin-4-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(2-pyridin-4-ylquinazolin-4-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-(4-pyridyl)quinazolin-4-yl]piperazine-1-carboxylate CAS Name: 4-(2-pyridin-4-yl-4-quinazolinyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-pyridin-4-ylquinazolin-4-yl)piperazine-1-carboxylate Traditional Name: 4-[2-(4-pyridyl)quinazolin-4-yl]piperazine-1-carboxylic acid tert-butyl ester Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CC=NC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CC=NC=C4

InChI

InChI=1S/C22H25N5O2/c1-22(2,3)29-21(28)27-14-12-26(13-15-27)20-17-6-4-5-7-18(17)24-19(25-20)16-8-10-23-11-9-16/h4-11H,12-15H2,1-3H3