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

Systemtic Name: N'-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-pyridin-3-yl-ethyl]-N-ethyl-ethanediamide Openeye Name: N'-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-(3-pyridyl)ethyl]-N-ethyl-oxamide CAS Name: N'-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-(3-pyridinyl)ethyl]-N-ethyloxamide IUPAC Name: N'-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-pyridin-3-ylethyl]-N-ethyloxamide Traditional Name: N'-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-(3-pyridyl)ethyl]-N-ethyl-oxamide Formula: C18H19N3O6S MolecularWeight: 405.42496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O6S/c1-2-20-17(22)18(23)21-10-16(12-4-3-7-19-9-12)28(24,25)13-5-6-14-15(8-13)27-11-26-14/h3-9,16H,2,10-11H2,1H3,(H,20,22)(H,21,23)