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

Systemtic Name: 5-acetamido-N-[(3-methoxyphenyl)methyl]-1-(phenylmethyl)pyrrolo[2,3-b]pyridine-3-carboxamide Openeye Name: 5-acetamido-1-benzyl-N-[(3-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine-3-carboxamide CAS Name: 5-acetamido-N-[(3-methoxyphenyl)methyl]-1-(phenylmethyl)-3-pyrrolo[2,3-b]pyridinecarboxamide IUPAC Name: 5-acetamido-1-benzyl-N-[(3-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine-3-carboxamide Traditional Name: 5-acetamido-1-benzyl-N-m-anisyl-pyrrolo[2,3-b]pyridine-3-carboxamide Formula: C25H24N4O3 MolecularWeight: 428.48306

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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(=CC=C4)OC

Isomeric SMILES

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

InChI

InChI=1S/C25H24N4O3/c1-17(30)28-20-12-22-23(25(31)27-13-19-9-6-10-21(11-19)32-2)16-29(24(22)26-14-20)15-18-7-4-3-5-8-18/h3-12,14,16H,13,15H2,1-2H3,(H,27,31)(H,28,30)