N'-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonyl-ethyl]-N-(2-morpholin-4-ylethyl)ethanediamide

Systemtic Name: N'-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonyl-ethyl]-N-(2-morpholin-4-ylethyl)ethanediamide Openeye Name: N'-[2-(1,3-benzodioxol-5-yl)-2-(2-thienylsulfonyl)ethyl]-N-(2-morpholinoethyl)oxamide CAS Name: N'-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonylethyl]-N-[2-(4-morpholinyl)ethyl]oxamide IUPAC Name: N'-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonylethyl]-N-(2-morpholin-4-ylethyl)oxamide Traditional Name: N'-[2-(1,3-benzodioxol-5-yl)-2-(2-thienylsulfonyl)ethyl]-N-(2-morpholinoethyl)oxamide Formula: C21H25N3O7S2 MolecularWeight: 495.5691

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC(=O)C(=O)NCC(C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1COCCN1CCNC(=O)C(=O)NCC(C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H25N3O7S2/c25-20(22-5-6-24-7-9-29-10-8-24)21(26)23-13-18(33(27,28)19-2-1-11-32-19)15-3-4-16-17(12-15)31-14-30-16/h1-4,11-12,18H,5-10,13-14H2,(H,22,25)(H,23,26)