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

Systemtic Name: 3-[(7-chloranyl-2-ethyl-quinazolin-4-yl)-phenethyl-amino]-N-(3-fluorophenyl)propanamide Openeye Name: 3-[(7-chloro-2-ethyl-quinazolin-4-yl)-phenethyl-amino]-N-(3-fluorophenyl)propanamide CAS Name: 3-[(7-chloro-2-ethyl-4-quinazolinyl)-phenethylamino]-N-(3-fluorophenyl)propanamide IUPAC Name: 3-[(7-chloro-2-ethylquinazolin-4-yl)-phenethylamino]-N-(3-fluorophenyl)propanamide Traditional Name: 3-[(7-chloro-2-ethyl-quinazolin-4-yl)-phenethyl-amino]-N-(3-fluorophenyl)propionamide Formula: C27H26ClFN4O MolecularWeight: 476.972943

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=CC(=C2)Cl)C(=N1)N(CCC3=CC=CC=C3)CCC(=O)NC4=CC(=CC=C4)F

Isomeric SMILES

CCC1=NC2=C(C=CC(=C2)Cl)C(=N1)N(CCC3=CC=CC=C3)CCC(=O)NC4=CC(=CC=C4)F

InChI

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