3-[(7-chloranyl-2-ethyl-quinazolin-4-yl)-(2-methylpropyl)amino]-N-(2-fluorophenyl)propanamide

Systemtic Name: 3-[(7-chloranyl-2-ethyl-quinazolin-4-yl)-(2-methylpropyl)amino]-N-(2-fluorophenyl)propanamide Openeye Name: 3-[(7-chloro-2-ethyl-quinazolin-4-yl)-isobutyl-amino]-N-(2-fluorophenyl)propanamide CAS Name: 3-[(7-chloro-2-ethyl-4-quinazolinyl)-(2-methylpropyl)amino]-N-(2-fluorophenyl)propanamide IUPAC Name: 3-[(7-chloro-2-ethylquinazolin-4-yl)-(2-methylpropyl)amino]-N-(2-fluorophenyl)propanamide Traditional Name: 3-[(7-chloro-2-ethyl-quinazolin-4-yl)-isobutyl-amino]-N-(2-fluorophenyl)propionamide Formula: C23H26ClFN4O MolecularWeight: 428.930143

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=CC(=C2)Cl)C(=N1)N(CCC(=O)NC3=CC=CC=C3F)CC(C)C

Isomeric SMILES

CCC1=NC2=C(C=CC(=C2)Cl)C(=N1)N(CCC(=O)NC3=CC=CC=C3F)CC(C)C

InChI

InChI=1S/C23H26ClFN4O/c1-4-21-26-20-13-16(24)9-10-17(20)23(28-21)29(14-15(2)3)12-11-22(30)27-19-8-6-5-7-18(19)25/h5-10,13,15H,4,11-12,14H2,1-3H3,(H,27,30)