2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(3-piperidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(3-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-[3-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-(3-piperidinosulfonylphenyl)acetamide Formula: C21H24N2O5S2 MolecularWeight: 448.55566

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CSC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CSC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H24N2O5S2/c24-21(15-29-17-7-8-19-20(14-17)28-12-11-27-19)22-16-5-4-6-18(13-16)30(25,26)23-9-2-1-3-10-23/h4-8,13-14H,1-3,9-12,15H2,(H,22,24)