5-acetamido-N-[(4-fluorophenyl)methyl]-1-(phenylmethyl)pyrrolo[2,3-b]pyridine-3-carboxamide

Systemtic Name: 5-acetamido-N-[(4-fluorophenyl)methyl]-1-(phenylmethyl)pyrrolo[2,3-b]pyridine-3-carboxamide Openeye Name: 5-acetamido-1-benzyl-N-[(4-fluorophenyl)methyl]pyrrolo[2,3-b]pyridine-3-carboxamide CAS Name: 5-acetamido-N-[(4-fluorophenyl)methyl]-1-(phenylmethyl)-3-pyrrolo[2,3-b]pyridinecarboxamide IUPAC Name: 5-acetamido-1-benzyl-N-[(4-fluorophenyl)methyl]pyrrolo[2,3-b]pyridine-3-carboxamide Traditional Name: 5-acetamido-1-benzyl-N-(4-fluorobenzyl)pyrrolo[2,3-b]pyridine-3-carboxamide Formula: C24H21FN4O2 MolecularWeight: 416.447543

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CN=C2C(=C1)C(=CN2CC3=CC=CC=C3)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

CC(=O)NC1=CN=C2C(=C1)C(=CN2CC3=CC=CC=C3)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C24H21FN4O2/c1-16(30)28-20-11-21-22(24(31)27-12-17-7-9-19(25)10-8-17)15-29(23(21)26-13-20)14-18-5-3-2-4-6-18/h2-11,13,15H,12,14H2,1H3,(H,27,31)(H,28,30)