5-(4-pyridin-2-ylpiperazin-1-yl)sulfonylisoquinoline

Systemtic Name: 5-(4-pyridin-2-ylpiperazin-1-yl)sulfonylisoquinoline Openeye Name: 5-[4-(2-pyridyl)piperazin-1-yl]sulfonylisoquinoline CAS Name: 5-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]isoquinoline IUPAC Name: 5-(4-pyridin-2-ylpiperazin-1-yl)sulfonylisoquinoline Traditional Name: 5-[4-(2-pyridyl)piperazino]sulfonylisoquinoline Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C18H18N4O2S/c23-25(24,17-5-3-4-15-14-19-9-7-16(15)17)22-12-10-21(11-13-22)18-6-1-2-8-20-18/h1-9,14H,10-13H2