methyl 5-morpholin-4-ylsulfonyl-6-(oxolan-2-ylmethylamino)pyridine-3-carboxylate

Systemtic Name: methyl 5-morpholin-4-ylsulfonyl-6-(oxolan-2-ylmethylamino)pyridine-3-carboxylate Openeye Name: methyl 5-morpholinosulfonyl-6-(tetrahydrofuran-2-ylmethylamino)pyridine-3-carboxylate CAS Name: 5-(4-morpholinylsulfonyl)-6-(2-oxolanylmethylamino)-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-morpholin-4-ylsulfonyl-6-(oxolan-2-ylmethylamino)pyridine-3-carboxylate Traditional Name: 5-morpholinosulfonyl-6-(tetrahydrofurfurylamino)nicotinic acid methyl ester Formula: C16H23N3O6S MolecularWeight: 385.43532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(N=C1)NCC2CCCO2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC(=O)C1=CC(=C(N=C1)NCC2CCCO2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C16H23N3O6S/c1-23-16(20)12-9-14(26(21,22)19-4-7-24-8-5-19)15(17-10-12)18-11-13-3-2-6-25-13/h9-10,13H,2-8,11H2,1H3,(H,17,18)