2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]ethanamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]ethanamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[2-[4-(2-pyridyl)piperazin-1-yl]sulfonylethyl]acetamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-[2-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]ethyl]acetamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]acetamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-[2-[4-(2-pyridyl)piperazino]sulfonylethyl]acetamide Formula: C21H26N4O5S2 MolecularWeight: 478.58494

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)S(=O)(=O)CCNC(=O)CSC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)S(=O)(=O)CCNC(=O)CSC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H26N4O5S2/c26-21(16-31-17-4-5-18-19(15-17)30-13-12-29-18)23-7-14-32(27,28)25-10-8-24(9-11-25)20-3-1-2-6-22-20/h1-6,15H,7-14,16H2,(H,23,26)