N-(cyclohexylmethyl)-5-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide

Systemtic Name: N-(cyclohexylmethyl)-5-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide Openeye Name: N-(cyclohexylmethyl)-5-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide CAS Name: N-(cyclohexylmethyl)-5-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide IUPAC Name: N-(cyclohexylmethyl)-5-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide Traditional Name: N-(cyclohexylmethyl)-5-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide Formula: C21H22FN3O MolecularWeight: 351.417283

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)C2=CNC3=NC=C(C=C23)C4=CC(=CC=C4)F

Isomeric SMILES

C1CCC(CC1)CNC(=O)C2=CNC3=NC=C(C=C23)C4=CC(=CC=C4)F

InChI

InChI=1S/C21H22FN3O/c22-17-8-4-7-15(9-17)16-10-18-19(13-24-20(18)23-12-16)21(26)25-11-14-5-2-1-3-6-14/h4,7-10,12-14H,1-3,5-6,11H2,(H,23,24)(H,25,26)