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

Systemtic Name: 3-[[7-chloranyl-2-(4-fluorophenyl)quinazolin-4-yl]-(2-methylpropyl)amino]-N-phenyl-propanamide Openeye Name: 3-[[7-chloro-2-(4-fluorophenyl)quinazolin-4-yl]-isobutyl-amino]-N-phenyl-propanamide CAS Name: 3-[[7-chloro-2-(4-fluorophenyl)-4-quinazolinyl]-(2-methylpropyl)amino]-N-phenylpropanamide IUPAC Name: 3-[[7-chloro-2-(4-fluorophenyl)quinazolin-4-yl]-(2-methylpropyl)amino]-N-phenylpropanamide Traditional Name: 3-[[7-chloro-2-(4-fluorophenyl)quinazolin-4-yl]-isobutyl-amino]-N-phenyl-propionamide Formula: C27H26ClFN4O MolecularWeight: 476.972943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CCC(=O)NC1=CC=CC=C1)C2=NC(=NC3=C2C=CC(=C3)Cl)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)CN(CCC(=O)NC1=CC=CC=C1)C2=NC(=NC3=C2C=CC(=C3)Cl)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H26ClFN4O/c1-18(2)17-33(15-14-25(34)30-22-6-4-3-5-7-22)27-23-13-10-20(28)16-24(23)31-26(32-27)19-8-11-21(29)12-9-19/h3-13,16,18H,14-15,17H2,1-2H3,(H,30,34)