ethyl 4,6-dimethyl-3-[2-(1-propylimidazol-2-yl)sulfanylethanoylamino]thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: ethyl 4,6-dimethyl-3-[2-(1-propylimidazol-2-yl)sulfanylethanoylamino]thieno[2,3-b]pyridine-2-carboxylate Openeye Name: ethyl 4,6-dimethyl-3-[[2-(1-propylimidazol-2-yl)sulfanylacetyl]amino]thieno[2,3-b]pyridine-2-carboxylate CAS Name: 4,6-dimethyl-3-[[1-oxo-2-[(1-propyl-2-imidazolyl)thio]ethyl]amino]-2-thieno[2,3-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 4,6-dimethyl-3-[[2-(1-propylimidazol-2-yl)sulfanylacetyl]amino]thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 4,6-dimethyl-3-[[2-[(1-propylimidazol-2-yl)thio]acetyl]amino]thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester Formula: C20H24N4O3S2 MolecularWeight: 432.55956

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=CN=C1SCC(=O)NC2=C(SC3=C2C(=CC(=N3)C)C)C(=O)OCC

Isomeric SMILES

CCCN1C=CN=C1SCC(=O)NC2=C(SC3=C2C(=CC(=N3)C)C)C(=O)OCC

InChI

InChI=1S/C20H24N4O3S2/c1-5-8-24-9-7-21-20(24)28-11-14(25)23-16-15-12(3)10-13(4)22-18(15)29-17(16)19(26)27-6-2/h7,9-10H,5-6,8,11H2,1-4H3,(H,23,25)