N-(4-tert-butylphenyl)-7-(3-chloranylpyridin-2-yl)-2-(ethoxymethyl)quinazolin-4-amine

Systemtic Name: N-(4-tert-butylphenyl)-7-(3-chloranylpyridin-2-yl)-2-(ethoxymethyl)quinazolin-4-amine Openeye Name: N-(4-tert-butylphenyl)-7-(3-chloro-2-pyridyl)-2-(ethoxymethyl)quinazolin-4-amine CAS Name: N-(4-tert-butylphenyl)-7-(3-chloro-2-pyridinyl)-2-(ethoxymethyl)-4-quinazolinamine IUPAC Name: N-(4-tert-butylphenyl)-7-(3-chloropyridin-2-yl)-2-(ethoxymethyl)quinazolin-4-amine Traditional Name: (4-tert-butylphenyl)-[7-(3-chloro-2-pyridyl)-2-(ethoxymethyl)quinazolin-4-yl]amine Formula: C26H27ClN4O MolecularWeight: 446.97178

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=NC2=C(C=CC(=C2)C3=C(C=CC=N3)Cl)C(=N1)NC4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CCOCC1=NC2=C(C=CC(=C2)C3=C(C=CC=N3)Cl)C(=N1)NC4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C26H27ClN4O/c1-5-32-16-23-30-22-15-17(24-21(27)7-6-14-28-24)8-13-20(22)25(31-23)29-19-11-9-18(10-12-19)26(2,3)4/h6-15H,5,16H2,1-4H3,(H,29,30,31)