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

Systemtic Name: 2-[1-ethyl-4-(5-fluoranyl-2-oxidanyl-phenyl)carbonyl-pyrrol-2-yl]-1H-quinazolin-4-one Openeye Name: 2-[1-ethyl-4-(5-fluoro-2-hydroxy-benzoyl)pyrrol-2-yl]-1H-quinazolin-4-one CAS Name: 2-[1-ethyl-4-[(5-fluoro-2-hydroxyphenyl)-oxomethyl]-2-pyrrolyl]-1H-quinazolin-4-one IUPAC Name: 2-[1-ethyl-4-(5-fluoro-2-hydroxybenzoyl)pyrrol-2-yl]-1H-quinazolin-4-one Traditional Name: 2-[1-ethyl-4-(5-fluoro-2-hydroxy-benzoyl)pyrrol-2-yl]-1H-quinazolin-4-one Formula: C21H16FN3O3 MolecularWeight: 377.368443

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=C1C2=NC(=O)C3=CC=CC=C3N2)C(=O)C4=C(C=CC(=C4)F)O

Isomeric SMILES

CCN1C=C(C=C1C2=NC(=O)C3=CC=CC=C3N2)C(=O)C4=C(C=CC(=C4)F)O

InChI

InChI=1S/C21H16FN3O3/c1-2-25-11-12(19(27)15-10-13(22)7-8-18(15)26)9-17(25)20-23-16-6-4-3-5-14(16)21(28)24-20/h3-11,26H,2H2,1H3,(H,23,24,28)