methyl 5-[[4-(1,3-benzothiazol-6-ylcarbonyl)morpholin-2-yl]methoxy]pyridine-3-carboxylate

Systemtic Name: methyl 5-[[4-(1,3-benzothiazol-6-ylcarbonyl)morpholin-2-yl]methoxy]pyridine-3-carboxylate Openeye Name: methyl 5-[[4-(1,3-benzothiazole-6-carbonyl)morpholin-2-yl]methoxy]pyridine-3-carboxylate CAS Name: 5-[[4-[1,3-benzothiazol-6-yl(oxo)methyl]-2-morpholinyl]methoxy]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-(1,3-benzothiazole-6-carbonyl)morpholin-2-yl]methoxy]pyridine-3-carboxylate Traditional Name: 5-[[4-(1,3-benzothiazole-6-carbonyl)morpholin-2-yl]methoxy]nicotinic acid methyl ester Formula: C20H19N3O5S MolecularWeight: 413.44696

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CN=C1)OCC2CN(CCO2)C(=O)C3=CC4=C(C=C3)N=CS4

Isomeric SMILES

COC(=O)C1=CC(=CN=C1)OCC2CN(CCO2)C(=O)C3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C20H19N3O5S/c1-26-20(25)14-6-15(9-21-8-14)28-11-16-10-23(4-5-27-16)19(24)13-2-3-17-18(7-13)29-12-22-17/h2-3,6-9,12,16H,4-5,10-11H2,1H3