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

Systemtic Name: N'-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonyl-ethyl]-N-(2-dimethylaminoethyl)ethanediamide Openeye Name: N'-[2-(1,3-benzodioxol-5-yl)-2-(2-thienylsulfonyl)ethyl]-N-(2-dimethylaminoethyl)oxamide CAS Name: N'-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonylethyl]-N-(2-dimethylaminoethyl)oxamide IUPAC Name: N'-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonylethyl]-N-(2-dimethylaminoethyl)oxamide Traditional Name: N'-[2-(1,3-benzodioxol-5-yl)-2-(2-thienylsulfonyl)ethyl]-N-(2-dimethylaminoethyl)oxamide Formula: C19H23N3O6S2 MolecularWeight: 453.53242

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C(=O)NCC(C1=CC2=C(C=C1)OCO2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN(C)CCNC(=O)C(=O)NCC(C1=CC2=C(C=C1)OCO2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C19H23N3O6S2/c1-22(2)8-7-20-18(23)19(24)21-11-16(30(25,26)17-4-3-9-29-17)13-5-6-14-15(10-13)28-12-27-14/h3-6,9-10,16H,7-8,11-12H2,1-2H3,(H,20,23)(H,21,24)