tert-butyl 4-[4-[(phenylmethyl)amino]quinazolin-2-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(phenylmethyl)amino]quinazolin-2-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-(benzylamino)quinazolin-2-yl]piperazine-1-carboxylate CAS Name: 4-[4-[(phenylmethyl)amino]-2-quinazolinyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(benzylamino)quinazolin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[4-(benzylamino)quinazolin-2-yl]piperazine-1-carboxylic acid tert-butyl ester Formula: C24H29N5O2 MolecularWeight: 419.51936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC3=CC=CC=C3C(=N2)NCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC3=CC=CC=C3C(=N2)NCC4=CC=CC=C4

InChI

InChI=1S/C24H29N5O2/c1-24(2,3)31-23(30)29-15-13-28(14-16-29)22-26-20-12-8-7-11-19(20)21(27-22)25-17-18-9-5-4-6-10-18/h4-12H,13-17H2,1-3H3,(H,25,26,27)