5-benzamido-1-[(4-tert-butylphenyl)methyl]pyrrolo[2,3-b]pyridine-3-carboxamide

Systemtic Name: 5-benzamido-1-[(4-tert-butylphenyl)methyl]pyrrolo[2,3-b]pyridine-3-carboxamide Openeye Name: 5-benzamido-1-[(4-tert-butylphenyl)methyl]pyrrolo[2,3-b]pyridine-3-carboxamide CAS Name: 5-benzamido-1-[(4-tert-butylphenyl)methyl]-3-pyrrolo[2,3-b]pyridinecarboxamide IUPAC Name: 5-benzamido-1-[(4-tert-butylphenyl)methyl]pyrrolo[2,3-b]pyridine-3-carboxamide Traditional Name: 5-benzamido-1-(4-tert-butylbenzyl)pyrrolo[2,3-b]pyridine-3-carboxamide Formula: C26H26N4O2 MolecularWeight: 426.51024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C=C(C3=CC(=CN=C32)NC(=O)C4=CC=CC=C4)C(=O)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C=C(C3=CC(=CN=C32)NC(=O)C4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C26H26N4O2/c1-26(2,3)19-11-9-17(10-12-19)15-30-16-22(23(27)31)21-13-20(14-28-24(21)30)29-25(32)18-7-5-4-6-8-18/h4-14,16H,15H2,1-3H3,(H2,27,31)(H,29,32)