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

Systemtic Name: methyl 5-morpholin-4-ylsulfonyl-6-(2-thiophen-3-ylethylamino)pyridine-3-carboxylate Openeye Name: methyl 5-morpholinosulfonyl-6-[2-(3-thienyl)ethylamino]pyridine-3-carboxylate CAS Name: 5-(4-morpholinylsulfonyl)-6-[2-(3-thiophenyl)ethylamino]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-morpholin-4-ylsulfonyl-6-(2-thiophen-3-ylethylamino)pyridine-3-carboxylate Traditional Name: 5-morpholinosulfonyl-6-[2-(3-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=CSC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC(=O)C1=CC(=C(N=C1)NCCC2=CSC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C17H21N3O5S2/c1-24-17(21)14-10-15(27(22,23)20-5-7-25-8-6-20)16(19-11-14)18-4-2-13-3-9-26-12-13/h3,9-12H,2,4-8H2,1H3,(H,18,19)