6-fluoranyl-3-(phenylsulfonyl)-5-piperazin-1-yl-1H-pyrrolo[2,3-b]pyridine

Systemtic Name: 6-fluoranyl-3-(phenylsulfonyl)-5-piperazin-1-yl-1H-pyrrolo[2,3-b]pyridine Openeye Name: 3-(benzenesulfonyl)-6-fluoro-5-piperazin-1-yl-1H-pyrrolo[2,3-b]pyridine CAS Name: 3-(benzenesulfonyl)-6-fluoro-5-(1-piperazinyl)-1H-pyrrolo[2,3-b]pyridine IUPAC Name: 3-(benzenesulfonyl)-6-fluoro-5-piperazin-1-yl-1H-pyrrolo[2,3-b]pyridine Traditional Name: 3-besyl-6-fluoro-5-piperazino-1H-pyrrolo[2,3-b]pyridine Formula: C17H17FN4O2S MolecularWeight: 360.405883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(N=C3C(=C2)C(=CN3)S(=O)(=O)C4=CC=CC=C4)F

Isomeric SMILES

C1CN(CCN1)C2=C(N=C3C(=C2)C(=CN3)S(=O)(=O)C4=CC=CC=C4)F

InChI

InChI=1S/C17H17FN4O2S/c18-16-14(22-8-6-19-7-9-22)10-13-15(11-20-17(13)21-16)25(23,24)12-4-2-1-3-5-12/h1-5,10-11,19H,6-9H2,(H,20,21)