3-[[4-(5-iodanylpyridin-3-yl)piperazin-1-yl]methyl]-1H-pyrrolo[2,3-b]pyridine

Systemtic Name: 3-[[4-(5-iodanylpyridin-3-yl)piperazin-1-yl]methyl]-1H-pyrrolo[2,3-b]pyridine Openeye Name: 3-[[4-(5-iodo-3-pyridyl)piperazin-1-yl]methyl]-1H-pyrrolo[2,3-b]pyridine CAS Name: 3-[[4-(5-iodo-3-pyridinyl)-1-piperazinyl]methyl]-1H-pyrrolo[2,3-b]pyridine IUPAC Name: 3-[[4-(5-iodopyridin-3-yl)piperazin-1-yl]methyl]-1H-pyrrolo[2,3-b]pyridine Traditional Name: 3-[[4-(5-iodo-3-pyridyl)piperazino]methyl]-1H-pyrrolo[2,3-b]pyridine Formula: C17H18IN5 MolecularWeight: 419.26279

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CNC3=C2C=CC=N3)C4=CC(=CN=C4)I

Isomeric SMILES

C1CN(CCN1CC2=CNC3=C2C=CC=N3)C4=CC(=CN=C4)I

InChI

InChI=1S/C17H18IN5/c18-14-8-15(11-19-10-14)23-6-4-22(5-7-23)12-13-9-21-17-16(13)2-1-3-20-17/h1-3,8-11H,4-7,12H2,(H,20,21)