trifluoromethyl 3-azanyl-4-(3-methoxyphenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: trifluoromethyl 3-azanyl-4-(3-methoxyphenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: trifluoromethyl 3-amino-4-(3-methoxyphenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-amino-4-(3-methoxyphenyl)-6-phenyl-2-thieno[2,3-b]pyridinecarboxylic acid trifluoromethyl ester IUPAC Name: trifluoromethyl 3-amino-4-(3-methoxyphenyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-amino-4-(3-methoxyphenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid trifluoromethyl ester Formula: C22H15F3N2O3S MolecularWeight: 444.42631

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CC(=NC3=C2C(=C(S3)C(=O)OC(F)(F)F)N)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC(=NC3=C2C(=C(S3)C(=O)OC(F)(F)F)N)C4=CC=CC=C4

InChI

InChI=1S/C22H15F3N2O3S/c1-29-14-9-5-8-13(10-14)15-11-16(12-6-3-2-4-7-12)27-20-17(15)18(26)19(31-20)21(28)30-22(23,24)25/h2-11H,26H2,1H3