tert-butyl 4-[[1-(4-azanylquinazolin-2-yl)piperidin-4-yl]amino]benzoate

Systemtic Name: tert-butyl 4-[[1-(4-azanylquinazolin-2-yl)piperidin-4-yl]amino]benzoate Openeye Name: tert-butyl 4-[[1-(4-aminoquinazolin-2-yl)-4-piperidyl]amino]benzoate CAS Name: 4-[[1-(4-amino-2-quinazolinyl)-4-piperidinyl]amino]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[1-(4-aminoquinazolin-2-yl)piperidin-4-yl]amino]benzoate Traditional Name: 4-[[1-(4-aminoquinazolin-2-yl)-4-piperidyl]amino]benzoic acid tert-butyl ester Formula: C24H29N5O2 MolecularWeight: 419.51936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC=C(C=C1)NC2CCN(CC2)C3=NC4=CC=CC=C4C(=N3)N

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC=C(C=C1)NC2CCN(CC2)C3=NC4=CC=CC=C4C(=N3)N

InChI

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