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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-(2-pyridin-3-yl-2-thiophen-2-ylsulfonyl-ethyl)ethanediamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-[2-(3-pyridyl)-2-(2-thienylsulfonyl)ethyl]oxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-[2-(3-pyridinyl)-2-thiophen-2-ylsulfonylethyl]oxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-(2-pyridin-3-yl-2-thiophen-2-ylsulfonylethyl)oxamide Traditional Name: N-piperonyl-N'-[2-(3-pyridyl)-2-(2-thienylsulfonyl)ethyl]oxamide Formula: C21H19N3O6S2 MolecularWeight: 473.52206

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C(=O)NCC(C3=CN=CC=C3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C(=O)NCC(C3=CN=CC=C3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H19N3O6S2/c25-20(23-10-14-5-6-16-17(9-14)30-13-29-16)21(26)24-12-18(15-3-1-7-22-11-15)32(27,28)19-4-2-8-31-19/h1-9,11,18H,10,12-13H2,(H,23,25)(H,24,26)