methyl 6-(morpholin-4-ylmethyl)-3-(2-phenylethanoylamino)thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 6-(morpholin-4-ylmethyl)-3-(2-phenylethanoylamino)thieno[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 6-(morpholinomethyl)-3-[(2-phenylacetyl)amino]thieno[2,3-b]pyridine-2-carboxylate CAS Name: 6-(4-morpholinylmethyl)-3-[(1-oxo-2-phenylethyl)amino]-2-thieno[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-(morpholin-4-ylmethyl)-3-[(2-phenylacetyl)amino]thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 6-(morpholinomethyl)-3-[(2-phenylacetyl)amino]thieno[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(S1)N=C(C=C2)CN3CCOCC3)NC(=O)CC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(C2=C(S1)N=C(C=C2)CN3CCOCC3)NC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C22H23N3O4S/c1-28-22(27)20-19(24-18(26)13-15-5-3-2-4-6-15)17-8-7-16(23-21(17)30-20)14-25-9-11-29-12-10-25/h2-8H,9-14H2,1H3,(H,24,26)