3-[(6S)-6-(3-fluorophenyl)-4-methyl-5-morpholin-4-ylcarbonyl-2-oxidanylidene-1,6-dihydropyrimidin-3-yl]benzoic acid

Systemtic Name: 3-[(6S)-6-(3-fluorophenyl)-4-methyl-5-morpholin-4-ylcarbonyl-2-oxidanylidene-1,6-dihydropyrimidin-3-yl]benzoic acid Openeye Name: 3-[(6S)-6-(3-fluorophenyl)-4-methyl-5-(morpholine-4-carbonyl)-2-oxo-1,6-dihydropyrimidin-3-yl]benzoic acid CAS Name: 3-[(6S)-6-(3-fluorophenyl)-4-methyl-5-[4-morpholinyl(oxo)methyl]-2-oxo-1,6-dihydropyrimidin-3-yl]benzoic acid IUPAC Name: 3-[(6S)-6-(3-fluorophenyl)-4-methyl-5-(morpholine-4-carbonyl)-2-oxo-1,6-dihydropyrimidin-3-yl]benzoic acid Traditional Name: 3-[(6S)-6-(3-fluorophenyl)-2-keto-4-methyl-5-(morpholine-4-carbonyl)-1,6-dihydropyrimidin-3-yl]benzoic acid Formula: C23H22FN3O5 MolecularWeight: 439.436283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1C2=CC=CC(=C2)C(=O)O)C3=CC(=CC=C3)F)C(=O)N4CCOCC4

Isomeric SMILES

CC1=C([C@@H](NC(=O)N1C2=CC=CC(=C2)C(=O)O)C3=CC(=CC=C3)F)C(=O)N4CCOCC4

InChI

InChI=1S/C23H22FN3O5/c1-14-19(21(28)26-8-10-32-11-9-26)20(15-4-2-6-17(24)12-15)25-23(31)27(14)18-7-3-5-16(13-18)22(29)30/h2-7,12-13,20H,8-11H2,1H3,(H,25,31)(H,29,30)/t20-/m0/s1