2-(4-bromophenyl)-4-[(2-ethylphenyl)amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide

Systemtic Name: 2-(4-bromophenyl)-4-[(2-ethylphenyl)amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide Openeye Name: 2-(4-bromophenyl)-4-(2-ethylanilino)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide CAS Name: 2-(4-bromophenyl)-4-(2-ethylanilino)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide IUPAC Name: 2-(4-bromophenyl)-4-(2-ethylanilino)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide Traditional Name: 2-(4-bromophenyl)-4-(2-ethylanilino)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide Formula: C22H19BrN4O MolecularWeight: 435.31646

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=C3C=C(NC3=NC=C2C(=O)N)C4=CC=C(C=C4)Br

Isomeric SMILES

CCC1=CC=CC=C1NC2=C3C=C(NC3=NC=C2C(=O)N)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H19BrN4O/c1-2-13-5-3-4-6-18(13)26-20-16-11-19(14-7-9-15(23)10-8-14)27-22(16)25-12-17(20)21(24)28/h3-12H,2H2,1H3,(H2,24,28)(H2,25,26,27)