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

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-5-[(4-methylphenyl)carbonylamino]pyrrolo[2,3-b]pyridine-3-carboxamide Openeye Name: 1-[(4-tert-butylphenyl)methyl]-5-[(4-methylbenzoyl)amino]pyrrolo[2,3-b]pyridine-3-carboxamide CAS Name: 1-[(4-tert-butylphenyl)methyl]-5-[[(4-methylphenyl)-oxomethyl]amino]-3-pyrrolo[2,3-b]pyridinecarboxamide IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-5-[(4-methylbenzoyl)amino]pyrrolo[2,3-b]pyridine-3-carboxamide Traditional Name: 1-(4-tert-butylbenzyl)-5-(p-toluoylamino)pyrrolo[2,3-b]pyridine-3-carboxamide Formula: C27H28N4O2 MolecularWeight: 440.53682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CN=C3C(=C2)C(=CN3CC4=CC=C(C=C4)C(C)(C)C)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CN=C3C(=C2)C(=CN3CC4=CC=C(C=C4)C(C)(C)C)C(=O)N

InChI

InChI=1S/C27H28N4O2/c1-17-5-9-19(10-6-17)26(33)30-21-13-22-23(24(28)32)16-31(25(22)29-14-21)15-18-7-11-20(12-8-18)27(2,3)4/h5-14,16H,15H2,1-4H3,(H2,28,32)(H,30,33)