(E)-2-phenyl-3-[4-(2-pyridin-3-ylethanoylamino)-1H-pyrrolo[2,3-b]pyridin-3-yl]prop-2-enamide

Systemtic Name: (E)-2-phenyl-3-[4-(2-pyridin-3-ylethanoylamino)-1H-pyrrolo[2,3-b]pyridin-3-yl]prop-2-enamide Openeye Name: (E)-2-phenyl-3-[4-[[2-(3-pyridyl)acetyl]amino]-1H-pyrrolo[2,3-b]pyridin-3-yl]prop-2-enamide CAS Name: (E)-3-[4-[[1-oxo-2-(3-pyridinyl)ethyl]amino]-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-phenyl-2-propenamide IUPAC Name: (E)-2-phenyl-3-[4-[(2-pyridin-3-ylacetyl)amino]-1H-pyrrolo[2,3-b]pyridin-3-yl]prop-2-enamide Traditional Name: (E)-2-phenyl-3-[4-[[2-(3-pyridyl)acetyl]amino]-1H-pyrrolo[2,3-b]pyridin-3-yl]acrylamide Formula: C23H19N5O2 MolecularWeight: 397.42926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=CC2=CNC3=NC=CC(=C23)NC(=O)CC4=CN=CC=C4)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)/C(=C\C2=CNC3=NC=CC(=C23)NC(=O)CC4=CN=CC=C4)/C(=O)N

InChI

InChI=1S/C23H19N5O2/c24-22(30)18(16-6-2-1-3-7-16)12-17-14-27-23-21(17)19(8-10-26-23)28-20(29)11-15-5-4-9-25-13-15/h1-10,12-14H,11H2,(H2,24,30)(H2,26,27,28,29)/b18-12+