N-(2-pyridin-4-ylethyl)-2-(2-thiophen-2-ylpyrrolo[2,3-b]pyridin-1-yl)ethanamide

Systemtic Name: N-(2-pyridin-4-ylethyl)-2-(2-thiophen-2-ylpyrrolo[2,3-b]pyridin-1-yl)ethanamide Openeye Name: N-[2-(4-pyridyl)ethyl]-2-[2-(2-thienyl)pyrrolo[2,3-b]pyridin-1-yl]acetamide CAS Name: N-(2-pyridin-4-ylethyl)-2-(2-thiophen-2-yl-1-pyrrolo[2,3-b]pyridinyl)acetamide IUPAC Name: N-(2-pyridin-4-ylethyl)-2-(2-thiophen-2-ylpyrrolo[2,3-b]pyridin-1-yl)acetamide Traditional Name: N-[2-(4-pyridyl)ethyl]-2-[2-(2-thienyl)pyrrolo[2,3-b]pyridin-1-yl]acetamide Formula: C20H18N4OS MolecularWeight: 362.44812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(N=C1)N(C(=C2)C3=CC=CS3)CC(=O)NCCC4=CC=NC=C4

Isomeric SMILES

C1=CC2=C(N=C1)N(C(=C2)C3=CC=CS3)CC(=O)NCCC4=CC=NC=C4

InChI

InChI=1S/C20H18N4OS/c25-19(22-11-7-15-5-9-21-10-6-15)14-24-17(18-4-2-12-26-18)13-16-3-1-8-23-20(16)24/h1-6,8-10,12-13H,7,11,14H2,(H,22,25)