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

Systemtic Name: (2S)-2-(4-bromanylphenoxy)-N-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-ethyl-propanamide Openeye Name: (2S)-2-(4-bromophenoxy)-N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethyl-propanamide CAS Name: (2S)-2-(4-bromophenoxy)-N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethylpropanamide IUPAC Name: (2S)-2-(4-bromophenoxy)-N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethylpropanamide Traditional Name: (2S)-2-(4-bromophenoxy)-N-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]-N-ethyl-propionamide Formula: C20H19BrClN3O3 MolecularWeight: 464.74016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCN(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/C20H19BrClN3O3/c1-3-25(20(27)12(2)28-15-7-4-13(21)5-8-15)11-18-23-17-10-14(22)6-9-16(17)19(26)24-18/h4-10,12H,3,11H2,1-2H3,(H,23,24,26)/t12-/m0/s1