N-(5-chloranyl-2-pyrrolidin-1-yl-phenyl)-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide

Systemtic Name: N-(5-chloranyl-2-pyrrolidin-1-yl-phenyl)-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide Openeye Name: N-(5-chloro-2-pyrrolidin-1-yl-phenyl)-3-(4-oxo-1H-quinazolin-2-yl)propanamide CAS Name: N-[5-chloro-2-(1-pyrrolidinyl)phenyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide IUPAC Name: N-(5-chloro-2-pyrrolidin-1-ylphenyl)-3-(4-oxo-1H-quinazolin-2-yl)propanamide Traditional Name: N-(5-chloro-2-pyrrolidino-phenyl)-3-(4-keto-1H-quinazolin-2-yl)propionamide Formula: C21H21ClN4O2 MolecularWeight: 396.87004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)Cl)NC(=O)CCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)Cl)NC(=O)CCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C21H21ClN4O2/c22-14-7-8-18(26-11-3-4-12-26)17(13-14)24-20(27)10-9-19-23-16-6-2-1-5-15(16)21(28)25-19/h1-2,5-8,13H,3-4,9-12H2,(H,24,27)(H,23,25,28)