ethyl 3-azanyl-6-ethyl-4-(3-fluoranylpyridin-4-yl)-2-pyridin-3-ylcarbonyl-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate

Systemtic Name: ethyl 3-azanyl-6-ethyl-4-(3-fluoranylpyridin-4-yl)-2-pyridin-3-ylcarbonyl-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate Openeye Name: ethyl 3-amino-6-ethyl-4-(3-fluoro-4-pyridyl)-2-(pyridine-3-carbonyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate CAS Name: 3-amino-6-ethyl-4-(3-fluoro-4-pyridinyl)-2-[oxo(3-pyridinyl)methyl]-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-6-ethyl-4-(3-fluoropyridin-4-yl)-2-(pyridine-3-carbonyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate Traditional Name: 3-amino-6-ethyl-4-(3-fluoro-4-pyridyl)-2-nicotinoyl-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylic acid ethyl ester Formula: C23H21FN4O3S MolecularWeight: 452.501243

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(C2=C(N1)SC(=C2N)C(=O)C3=CN=CC=C3)C4=C(C=NC=C4)F)C(=O)OCC

Isomeric SMILES

CCC1=C(C(C2=C(N1)SC(=C2N)C(=O)C3=CN=CC=C3)C4=C(C=NC=C4)F)C(=O)OCC

InChI

InChI=1S/C23H21FN4O3S/c1-3-15-17(23(30)31-4-2)16(13-7-9-27-11-14(13)24)18-19(25)21(32-22(18)28-15)20(29)12-6-5-8-26-10-12/h5-11,16,28H,3-4,25H2,1-2H3