N-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-6-fluoranyl-5-(2-morpholin-2-ylethoxy)-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: N-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-6-fluoranyl-5-(2-morpholin-2-ylethoxy)-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[(3-chloro-4-fluoro-phenyl)methyl]-6-fluoro-5-(2-morpholin-2-ylethoxy)-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[(3-chloro-4-fluorophenyl)methyl]-6-fluoro-5-[2-(2-morpholinyl)ethoxy]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[(3-chloro-4-fluorophenyl)methyl]-6-fluoro-5-(2-morpholin-2-ylethoxy)-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: N-(3-chloro-4-fluoro-benzyl)-6-fluoro-4-keto-5-(2-morpholin-2-ylethoxy)-1H-quinazoline-2-carboxamide Formula: C22H21ClF2N4O4 MolecularWeight: 478.876346

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CN1)CCOC2=C(C=CC3=C2C(=O)N=C(N3)C(=O)NCC4=CC(=C(C=C4)F)Cl)F

Isomeric SMILES

C1COC(CN1)CCOC2=C(C=CC3=C2C(=O)N=C(N3)C(=O)NCC4=CC(=C(C=C4)F)Cl)F

InChI

InChI=1S/C22H21ClF2N4O4/c23-14-9-12(1-2-15(14)24)10-27-22(31)20-28-17-4-3-16(25)19(18(17)21(30)29-20)33-7-5-13-11-26-6-8-32-13/h1-4,9,13,26H,5-8,10-11H2,(H,27,31)(H,28,29,30)