ethyl 5-azanyl-6-cyano-2-[(4-fluorophenyl)amino]-7-phenyl-thieno[3,2-b]pyridine-3-carboxylate

Systemtic Name: ethyl 5-azanyl-6-cyano-2-[(4-fluorophenyl)amino]-7-phenyl-thieno[3,2-b]pyridine-3-carboxylate Openeye Name: ethyl 5-amino-6-cyano-2-(4-fluoroanilino)-7-phenyl-thieno[3,2-b]pyridine-3-carboxylate CAS Name: 5-amino-6-cyano-2-(4-fluoroanilino)-7-phenyl-3-thieno[3,2-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-6-cyano-2-(4-fluoroanilino)-7-phenylthieno[3,2-b]pyridine-3-carboxylate Traditional Name: 5-amino-6-cyano-2-(4-fluoroanilino)-7-phenyl-thieno[3,2-b]pyridine-3-carboxylic acid ethyl ester Formula: C23H17FN4O2S MolecularWeight: 432.470083

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1N=C(C(=C2C3=CC=CC=C3)C#N)N)NC4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1N=C(C(=C2C3=CC=CC=C3)C#N)N)NC4=CC=C(C=C4)F

InChI

InChI=1S/C23H17FN4O2S/c1-2-30-23(29)18-19-20(31-22(18)27-15-10-8-14(24)9-11-15)17(13-6-4-3-5-7-13)16(12-25)21(26)28-19/h3-11,27H,2H2,1H3,(H2,26,28)