methyl 5-[[4-[(2-bromanyl-4-fluoranyl-phenyl)carbamothioyl]morpholin-2-yl]methoxy]pyridine-3-carboxylate

Systemtic Name: methyl 5-[[4-[(2-bromanyl-4-fluoranyl-phenyl)carbamothioyl]morpholin-2-yl]methoxy]pyridine-3-carboxylate Openeye Name: methyl 5-[[4-[(2-bromo-4-fluoro-phenyl)carbamothioyl]morpholin-2-yl]methoxy]pyridine-3-carboxylate CAS Name: 5-[[4-[(2-bromo-4-fluoroanilino)-sulfanylidenemethyl]-2-morpholinyl]methoxy]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-[(2-bromo-4-fluorophenyl)carbamothioyl]morpholin-2-yl]methoxy]pyridine-3-carboxylate Traditional Name: 5-[[4-[(2-bromo-4-fluoro-phenyl)thiocarbamoyl]morpholin-2-yl]methoxy]nicotinic acid methyl ester Formula: C19H19BrFN3O4S MolecularWeight: 484.339263

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CN=C1)OCC2CN(CCO2)C(=S)NC3=C(C=C(C=C3)F)Br

Isomeric SMILES

COC(=O)C1=CC(=CN=C1)OCC2CN(CCO2)C(=S)NC3=C(C=C(C=C3)F)Br

InChI

InChI=1S/C19H19BrFN3O4S/c1-26-18(25)12-6-14(9-22-8-12)28-11-15-10-24(4-5-27-15)19(29)23-17-3-2-13(21)7-16(17)20/h2-3,6-9,15H,4-5,10-11H2,1H3,(H,23,29)