N-(2-fluoranyl-5-methyl-phenyl)-2-[(4-morpholin-4-yl-6-phenylazanyl-1,3,5-triazin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(2-fluoranyl-5-methyl-phenyl)-2-[(4-morpholin-4-yl-6-phenylazanyl-1,3,5-triazin-2-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-anilino-6-morpholino-1,3,5-triazin-2-yl)sulfanyl]-N-(2-fluoro-5-methyl-phenyl)acetamide CAS Name: 2-[[4-anilino-6-(4-morpholinyl)-1,3,5-triazin-2-yl]thio]-N-(2-fluoro-5-methylphenyl)acetamide IUPAC Name: 2-[(4-anilino-6-morpholin-4-yl-1,3,5-triazin-2-yl)sulfanyl]-N-(2-fluoro-5-methylphenyl)acetamide Traditional Name: 2-[(4-anilino-6-morpholino-s-triazin-2-yl)thio]-N-(2-fluoro-5-methyl-phenyl)acetamide Formula: C22H23FN6O2S MolecularWeight: 454.520423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)F)NC(=O)CSC2=NC(=NC(=N2)NC3=CC=CC=C3)N4CCOCC4

Isomeric SMILES

CC1=CC(=C(C=C1)F)NC(=O)CSC2=NC(=NC(=N2)NC3=CC=CC=C3)N4CCOCC4

InChI

InChI=1S/C22H23FN6O2S/c1-15-7-8-17(23)18(13-15)25-19(30)14-32-22-27-20(24-16-5-3-2-4-6-16)26-21(28-22)29-9-11-31-12-10-29/h2-8,13H,9-12,14H2,1H3,(H,25,30)(H,24,26,27,28)