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

Systemtic Name: 3-[[4-(1-benzothiophen-2-yl)piperazin-1-yl]methyl]-1H-pyrrolo[2,3-b]pyridine Openeye Name: 3-[[4-(benzothiophen-2-yl)piperazin-1-yl]methyl]-1H-pyrrolo[2,3-b]pyridine CAS Name: 3-[[4-(1-benzothiophen-2-yl)-1-piperazinyl]methyl]-1H-pyrrolo[2,3-b]pyridine IUPAC Name: 3-[[4-(1-benzothiophen-2-yl)piperazin-1-yl]methyl]-1H-pyrrolo[2,3-b]pyridine Traditional Name: 3-[[4-(benzothiophen-2-yl)piperazino]methyl]-1H-pyrrolo[2,3-b]pyridine Formula: C20H20N4S MolecularWeight: 348.4646

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CNC3=C2C=CC=N3)C4=CC5=CC=CC=C5S4

Isomeric SMILES

C1CN(CCN1CC2=CNC3=C2C=CC=N3)C4=CC5=CC=CC=C5S4

InChI

InChI=1S/C20H20N4S/c1-2-6-18-15(4-1)12-19(25-18)24-10-8-23(9-11-24)14-16-13-22-20-17(16)5-3-7-21-20/h1-7,12-13H,8-11,14H2,(H,21,22)