N-[[1-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpropyl]piperidin-4-yl]methyl]-2,3-dihydro-1,4-benzodioxine-5-carboxamide

Systemtic Name: N-[[1-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpropyl]piperidin-4-yl]methyl]-2,3-dihydro-1,4-benzodioxine-5-carboxamide Openeye Name: N-[[1-[3-[4-(2-pyridyl)piperazin-1-yl]sulfonylpropyl]-4-piperidyl]methyl]-2,3-dihydro-1,4-benzodioxine-5-carboxamide CAS Name: N-[[1-[3-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]propyl]-4-piperidinyl]methyl]-2,3-dihydro-1,4-benzodioxin-5-carboxamide IUPAC Name: N-[[1-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpropyl]piperidin-4-yl]methyl]-2,3-dihydro-1,4-benzodioxine-5-carboxamide Traditional Name: N-[[1-[3-[4-(2-pyridyl)piperazino]sulfonylpropyl]-4-piperidyl]methyl]-2,3-dihydro-1,4-benzodioxin-5-carboxamide Formula: C27H37N5O5S MolecularWeight: 543.67818

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC(=O)C2=C3C(=CC=C2)OCCO3)CCCS(=O)(=O)N4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

C1CN(CCC1CNC(=O)C2=C3C(=CC=C2)OCCO3)CCCS(=O)(=O)N4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C27H37N5O5S/c33-27(23-5-3-6-24-26(23)37-19-18-36-24)29-21-22-8-12-30(13-9-22)11-4-20-38(34,35)32-16-14-31(15-17-32)25-7-1-2-10-28-25/h1-3,5-7,10,22H,4,8-9,11-21H2,(H,29,33)