[6-(5-bromanyl-2-fluoranyl-phenyl)-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidin-5-yl]-morpholin-4-yl-methanone

Systemtic Name: [6-(5-bromanyl-2-fluoranyl-phenyl)-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidin-5-yl]-morpholin-4-yl-methanone Openeye Name: [6-(5-bromo-2-fluoro-phenyl)-4-methyl-3-phenyl-2-thioxo-1,6-dihydropyrimidin-5-yl]-morpholino-methanone CAS Name: [6-(5-bromo-2-fluorophenyl)-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidin-5-yl]-(4-morpholinyl)methanone IUPAC Name: [6-(5-bromo-2-fluorophenyl)-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidin-5-yl]-morpholin-4-ylmethanone Traditional Name: [6-(5-bromo-2-fluoro-phenyl)-4-methyl-3-phenyl-2-thioxo-1,6-dihydropyrimidin-5-yl]-morpholino-methanone Formula: C22H21BrFN3O2S MolecularWeight: 490.388443

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21BrFN3O2S/c1-14-19(21(28)26-9-11-29-12-10-26)20(17-13-15(23)7-8-18(17)24)25-22(30)27(14)16-5-3-2-4-6-16/h2-8,13,20H,9-12H2,1H3,(H,25,30)