N-[2-(5-pyridin-2-ylsulfanyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]ethanamide

Systemtic Name: N-[2-(5-pyridin-2-ylsulfanyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]ethanamide Openeye Name: N-[2-[5-(2-pyridylsulfanyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]ethyl]acetamide CAS Name: N-[2-[5-(2-pyridinylthio)-1H-pyrrolo[2,3-b]pyridin-3-yl]ethyl]acetamide IUPAC Name: N-[2-(5-pyridin-2-ylsulfanyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]acetamide Traditional Name: N-[2-[5-(2-pyridylthio)-1H-pyrrolo[2,3-b]pyridin-3-yl]ethyl]acetamide Formula: C16H16N4OS MolecularWeight: 312.38944

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC1=CNC2=NC=C(C=C12)SC3=CC=CC=N3

Isomeric SMILES

CC(=O)NCCC1=CNC2=NC=C(C=C12)SC3=CC=CC=N3

InChI

InChI=1S/C16H16N4OS/c1-11(21)17-7-5-12-9-19-16-14(12)8-13(10-20-16)22-15-4-2-3-6-18-15/h2-4,6,8-10H,5,7H2,1H3,(H,17,21)(H,19,20)