ethyl 3-(4-fluorophenyl)-2-pyrimidin-4-yl-pyrrolo[3,2-b]pyridine-1-carboxylate

Systemtic Name: ethyl 3-(4-fluorophenyl)-2-pyrimidin-4-yl-pyrrolo[3,2-b]pyridine-1-carboxylate Openeye Name: ethyl 3-(4-fluorophenyl)-2-pyrimidin-4-yl-pyrrolo[3,2-b]pyridine-1-carboxylate CAS Name: 3-(4-fluorophenyl)-2-(4-pyrimidinyl)-1-pyrrolo[3,2-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-fluorophenyl)-2-pyrimidin-4-ylpyrrolo[3,2-b]pyridine-1-carboxylate Traditional Name: 3-(4-fluorophenyl)-2-(4-pyrimidyl)pyrrolo[3,2-b]pyridine-1-carboxylic acid ethyl ester Formula: C20H15FN4O2 MolecularWeight: 362.357103

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2=C(C(=C1C3=NC=NC=C3)C4=CC=C(C=C4)F)N=CC=C2

Isomeric SMILES

CCOC(=O)N1C2=C(C(=C1C3=NC=NC=C3)C4=CC=C(C=C4)F)N=CC=C2

InChI

InChI=1S/C20H15FN4O2/c1-2-27-20(26)25-16-4-3-10-23-18(16)17(13-5-7-14(21)8-6-13)19(25)15-9-11-22-12-24-15/h3-12H,2H2,1H3