3-fluoranyl-N-[6-[(2-methylphenyl)amino]-2-oxidanylidene-1H-pyrimidin-5-yl]-5-morpholin-4-yl-benzamide

Systemtic Name: 3-fluoranyl-N-[6-[(2-methylphenyl)amino]-2-oxidanylidene-1H-pyrimidin-5-yl]-5-morpholin-4-yl-benzamide Openeye Name: 3-fluoro-N-[6-(2-methylanilino)-2-oxo-1H-pyrimidin-5-yl]-5-morpholino-benzamide CAS Name: 3-fluoro-N-[6-(2-methylanilino)-2-oxo-1H-pyrimidin-5-yl]-5-(4-morpholinyl)benzamide IUPAC Name: 3-fluoro-N-[6-(2-methylanilino)-2-oxo-1H-pyrimidin-5-yl]-5-morpholin-4-ylbenzamide Traditional Name: 3-fluoro-N-[2-keto-6-(o-toluidino)-1H-pyrimidin-5-yl]-5-morpholino-benzamide Formula: C22H22FN5O3 MolecularWeight: 423.440183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=C(C=NC(=O)N2)NC(=O)C3=CC(=CC(=C3)F)N4CCOCC4

Isomeric SMILES

CC1=CC=CC=C1NC2=C(C=NC(=O)N2)NC(=O)C3=CC(=CC(=C3)F)N4CCOCC4

InChI

InChI=1S/C22H22FN5O3/c1-14-4-2-3-5-18(14)25-20-19(13-24-22(30)27-20)26-21(29)15-10-16(23)12-17(11-15)28-6-8-31-9-7-28/h2-5,10-13H,6-9H2,1H3,(H,26,29)(H2,24,25,27,30)