methyl 5-thiophen-2-yl-7-(trifluoromethyl)-1H-pyrrolo[3,2-b]pyridine-2-carboxylate

Systemtic Name: methyl 5-thiophen-2-yl-7-(trifluoromethyl)-1H-pyrrolo[3,2-b]pyridine-2-carboxylate Openeye Name: methyl 5-(2-thienyl)-7-(trifluoromethyl)-1H-pyrrolo[3,2-b]pyridine-2-carboxylate CAS Name: 5-thiophen-2-yl-7-(trifluoromethyl)-1H-pyrrolo[3,2-b]pyridine-2-carboxylic acid methyl ester IUPAC Name: methyl 5-thiophen-2-yl-7-(trifluoromethyl)-1H-pyrrolo[3,2-b]pyridine-2-carboxylate Traditional Name: 5-(2-thienyl)-7-(trifluoromethyl)-1H-pyrrolo[3,2-b]pyridine-2-carboxylic acid methyl ester Formula: C14H9F3N2O2S MolecularWeight: 326.29367

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(N1)C(=CC(=N2)C3=CC=CS3)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC2=C(N1)C(=CC(=N2)C3=CC=CS3)C(F)(F)F

InChI

InChI=1S/C14H9F3N2O2S/c1-21-13(20)10-6-9-12(19-10)7(14(15,16)17)5-8(18-9)11-3-2-4-22-11/h2-6,19H,1H3