7-chloranyl-2-[1-ethyl-4-(5-fluoranyl-2-oxidanyl-phenyl)carbonyl-pyrrol-2-yl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[1-ethyl-4-(5-fluoranyl-2-oxidanyl-phenyl)carbonyl-pyrrol-2-yl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[1-ethyl-4-(5-fluoro-2-hydroxy-benzoyl)pyrrol-2-yl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[1-ethyl-4-[(5-fluoro-2-hydroxyphenyl)-oxomethyl]-2-pyrrolyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[1-ethyl-4-(5-fluoro-2-hydroxybenzoyl)pyrrol-2-yl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[1-ethyl-4-(5-fluoro-2-hydroxy-benzoyl)pyrrol-2-yl]-1H-quinazolin-4-one Formula: C21H15ClFN3O3 MolecularWeight: 411.813503

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=C1C2=NC(=O)C3=C(N2)C=C(C=C3)Cl)C(=O)C4=C(C=CC(=C4)F)O

Isomeric SMILES

CCN1C=C(C=C1C2=NC(=O)C3=C(N2)C=C(C=C3)Cl)C(=O)C4=C(C=CC(=C4)F)O

InChI

InChI=1S/C21H15ClFN3O3/c1-2-26-10-11(19(28)15-9-13(23)4-6-18(15)27)7-17(26)20-24-16-8-12(22)3-5-14(16)21(29)25-20/h3-10,27H,2H2,1H3,(H,24,25,29)