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

Systemtic Name: 3-[[4-(5-iodanylpyridin-2-yl)piperazin-1-yl]methyl]-1H-pyrrolo[2,3-b]pyridine Openeye Name: 3-[[4-(5-iodo-2-pyridyl)piperazin-1-yl]methyl]-1H-pyrrolo[2,3-b]pyridine CAS Name: 3-[[4-(5-iodo-2-pyridinyl)-1-piperazinyl]methyl]-1H-pyrrolo[2,3-b]pyridine IUPAC Name: 3-[[4-(5-iodopyridin-2-yl)piperazin-1-yl]methyl]-1H-pyrrolo[2,3-b]pyridine Traditional Name: 3-[[4-(5-iodo-2-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=NC=C(C=C4)I

Isomeric SMILES

C1CN(CCN1CC2=CNC3=C2C=CC=N3)C4=NC=C(C=C4)I

InChI

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