methyl 3-(furan-2-ylcarbonylamino)-6-(piperidin-1-ylmethyl)thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 3-(furan-2-ylcarbonylamino)-6-(piperidin-1-ylmethyl)thieno[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 3-(furan-2-carbonylamino)-6-(1-piperidylmethyl)thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-[[2-furanyl(oxo)methyl]amino]-6-(1-piperidinylmethyl)-2-thieno[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-(furan-2-carbonylamino)-6-(piperidin-1-ylmethyl)thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-(2-furoylamino)-6-(piperidinomethyl)thieno[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(S1)N=C(C=C2)CN3CCCCC3)NC(=O)C4=CC=CO4

Isomeric SMILES

COC(=O)C1=C(C2=C(S1)N=C(C=C2)CN3CCCCC3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C20H21N3O4S/c1-26-20(25)17-16(22-18(24)15-6-5-11-27-15)14-8-7-13(21-19(14)28-17)12-23-9-3-2-4-10-23/h5-8,11H,2-4,9-10,12H2,1H3,(H,22,24)