N'-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-pyridin-3-yl-ethyl]-N-butyl-ethanediamide

Systemtic Name: N'-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-pyridin-3-yl-ethyl]-N-butyl-ethanediamide Openeye Name: N'-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-(3-pyridyl)ethyl]-N-butyl-oxamide CAS Name: N'-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-(3-pyridinyl)ethyl]-N-butyloxamide IUPAC Name: N'-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-pyridin-3-ylethyl]-N-butyloxamide Traditional Name: N'-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-(3-pyridyl)ethyl]-N-butyl-oxamide Formula: C20H23N3O6S MolecularWeight: 433.47812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(=O)NCC(C1=CN=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCCNC(=O)C(=O)NCC(C1=CN=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H23N3O6S/c1-2-3-9-22-19(24)20(25)23-12-18(14-5-4-8-21-11-14)30(26,27)15-6-7-16-17(10-15)29-13-28-16/h4-8,10-11,18H,2-3,9,12-13H2,1H3,(H,22,24)(H,23,25)