2-[[2-(4-tert-butylphenyl)quinazolin-4-yl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[2-(4-tert-butylphenyl)quinazolin-4-yl]amino]-3-methyl-butanoic acid Openeye Name: 2-[[2-(4-tert-butylphenyl)quinazolin-4-yl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(4-tert-butylphenyl)-4-quinazolinyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(4-tert-butylphenyl)quinazolin-4-yl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(4-tert-butylphenyl)quinazolin-4-yl]amino]-3-methyl-butyric acid Formula: C23H27N3O2 MolecularWeight: 377.47938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC1=NC(=NC2=CC=CC=C21)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC(C)C(C(=O)O)NC1=NC(=NC2=CC=CC=C21)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C23H27N3O2/c1-14(2)19(22(27)28)25-21-17-8-6-7-9-18(17)24-20(26-21)15-10-12-16(13-11-15)23(3,4)5/h6-14,19H,1-5H3,(H,27,28)(H,24,25,26)