ethyl 4-[[2-(4-tert-butylphenyl)quinazolin-4-yl]amino]benzoate

Systemtic Name: ethyl 4-[[2-(4-tert-butylphenyl)quinazolin-4-yl]amino]benzoate Openeye Name: ethyl 4-[[2-(4-tert-butylphenyl)quinazolin-4-yl]amino]benzoate CAS Name: 4-[[2-(4-tert-butylphenyl)-4-quinazolinyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(4-tert-butylphenyl)quinazolin-4-yl]amino]benzoate Traditional Name: 4-[[2-(4-tert-butylphenyl)quinazolin-4-yl]amino]benzoic acid ethyl ester Formula: C27H27N3O2 MolecularWeight: 425.52218

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C27H27N3O2/c1-5-32-26(31)19-12-16-21(17-13-19)28-25-22-8-6-7-9-23(22)29-24(30-25)18-10-14-20(15-11-18)27(2,3)4/h6-17H,5H2,1-4H3,(H,28,29,30)