methyl 5-morpholin-4-ylsulfonyl-6-(2-thiophen-2-ylethylamino)pyridine-3-carboxylate

Systemtic Name: methyl 5-morpholin-4-ylsulfonyl-6-(2-thiophen-2-ylethylamino)pyridine-3-carboxylate Openeye Name: methyl 5-morpholinosulfonyl-6-[2-(2-thienyl)ethylamino]pyridine-3-carboxylate CAS Name: 5-(4-morpholinylsulfonyl)-6-(2-thiophen-2-ylethylamino)-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-morpholin-4-ylsulfonyl-6-(2-thiophen-2-ylethylamino)pyridine-3-carboxylate Traditional Name: 5-morpholinosulfonyl-6-[2-(2-thienyl)ethylamino]nicotinic acid methyl ester Formula: C17H21N3O5S2 MolecularWeight: 411.49574

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(N=C1)NCCC2=CC=CS2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC(=O)C1=CC(=C(N=C1)NCCC2=CC=CS2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C17H21N3O5S2/c1-24-17(21)13-11-15(27(22,23)20-6-8-25-9-7-20)16(19-12-13)18-5-4-14-3-2-10-26-14/h2-3,10-12H,4-9H2,1H3,(H,18,19)