diethyl 3-methyl-5-[[5-(piperidin-1-ylmethyl)furan-2-yl]carbonylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[[5-(piperidin-1-ylmethyl)furan-2-yl]carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[5-(1-piperidylmethyl)furan-2-carbonyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[oxo-[5-(1-piperidinylmethyl)-2-furanyl]methyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[5-(piperidin-1-ylmethyl)furan-2-carbonyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[5-(piperidinomethyl)-2-furoyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C22H28N2O6S MolecularWeight: 448.53252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CC=C(O2)CN3CCCCC3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CC=C(O2)CN3CCCCC3

InChI

InChI=1S/C22H28N2O6S/c1-4-28-21(26)17-14(3)18(22(27)29-5-2)31-20(17)23-19(25)16-10-9-15(30-16)13-24-11-7-6-8-12-24/h9-10H,4-8,11-13H2,1-3H3,(H,23,25)