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

Systemtic Name: N-[5-chloranyl-2-(4-ethoxyphenoxy)phenyl]-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide Openeye Name: N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide CAS Name: N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide IUPAC Name: N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide Traditional Name: N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]-3-(4-keto-1H-quinazolin-2-yl)propionamide Formula: C25H22ClN3O4 MolecularWeight: 463.91288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)NC(=O)CCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)NC(=O)CCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C25H22ClN3O4/c1-2-32-17-8-10-18(11-9-17)33-22-12-7-16(26)15-21(22)28-24(30)14-13-23-27-20-6-4-3-5-19(20)25(31)29-23/h3-12,15H,2,13-14H2,1H3,(H,28,30)(H,27,29,31)