3-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl]-7-fluoranyl-quinazolin-4-one

Systemtic Name: 3-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl]-7-fluoranyl-quinazolin-4-one Openeye Name: 3-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxo-ethyl]-7-fluoro-quinazolin-4-one CAS Name: 3-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl]-7-fluoro-4-quinazolinone IUPAC Name: 3-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl]-7-fluoroquinazolin-4-one Traditional Name: 3-[2-(2,5-dimethyl-1-piperonyl-pyrrol-3-yl)-2-keto-ethyl]-7-fluoro-quinazolin-4-one Formula: C24H20FN3O4 MolecularWeight: 433.431703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC3=C(C=C2)OCO3)C)C(=O)CN4C=NC5=C(C4=O)C=CC(=C5)F

Isomeric SMILES

CC1=CC(=C(N1CC2=CC3=C(C=C2)OCO3)C)C(=O)CN4C=NC5=C(C4=O)C=CC(=C5)F

InChI

InChI=1S/C24H20FN3O4/c1-14-7-19(15(2)28(14)10-16-3-6-22-23(8-16)32-13-31-22)21(29)11-27-12-26-20-9-17(25)4-5-18(20)24(27)30/h3-9,12H,10-11,13H2,1-2H3