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

Systemtic Name: N-(4-bromanyl-2-fluoranyl-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-(4-bromo-2-fluoro-phenyl)acetamide CAS Name: 2-[[4-anilino-6-(4-morpholinyl)-1,3,5-triazin-2-yl]thio]-N-(4-bromo-2-fluorophenyl)acetamide IUPAC Name: 2-[(4-anilino-6-morpholin-4-yl-1,3,5-triazin-2-yl)sulfanyl]-N-(4-bromo-2-fluorophenyl)acetamide Traditional Name: 2-[(4-anilino-6-morpholino-s-triazin-2-yl)thio]-N-(4-bromo-2-fluoro-phenyl)acetamide Formula: C21H20BrFN6O2S MolecularWeight: 519.389903

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=NC(=N2)SCC(=O)NC3=C(C=C(C=C3)Br)F)NC4=CC=CC=C4

Isomeric SMILES

C1COCCN1C2=NC(=NC(=N2)SCC(=O)NC3=C(C=C(C=C3)Br)F)NC4=CC=CC=C4

InChI

InChI=1S/C21H20BrFN6O2S/c22-14-6-7-17(16(23)12-14)25-18(30)13-32-21-27-19(24-15-4-2-1-3-5-15)26-20(28-21)29-8-10-31-11-9-29/h1-7,12H,8-11,13H2,(H,25,30)(H,24,26,27,28)