(2S)-2-(4-bromanylphenoxy)-N-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-propyl-propanamide

Systemtic Name: (2S)-2-(4-bromanylphenoxy)-N-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-propyl-propanamide Openeye Name: (2S)-2-(4-bromophenoxy)-N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-propyl-propanamide CAS Name: (2S)-2-(4-bromophenoxy)-N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-propylpropanamide IUPAC Name: (2S)-2-(4-bromophenoxy)-N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-propylpropanamide Traditional Name: (2S)-2-(4-bromophenoxy)-N-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]-N-propyl-propionamide Formula: C21H21BrClN3O3 MolecularWeight: 478.76674

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)C(C)OC3=CC=C(C=C3)Br

Isomeric SMILES

CCCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)[C@H](C)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H21BrClN3O3/c1-3-10-26(21(28)13(2)29-16-7-4-14(22)5-8-16)12-19-24-18-11-15(23)6-9-17(18)20(27)25-19/h4-9,11,13H,3,10,12H2,1-2H3,(H,24,25,27)/t13-/m0/s1