ethyl 4-[2-[5-(diethylsulfamoyl)pyridin-2-yl]sulfanylethanoylamino]butanoate

Systemtic Name: ethyl 4-[2-[5-(diethylsulfamoyl)pyridin-2-yl]sulfanylethanoylamino]butanoate Openeye Name: ethyl 4-[[2-[[5-(diethylsulfamoyl)-2-pyridyl]sulfanyl]acetyl]amino]butanoate CAS Name: 4-[[2-[[5-(diethylsulfamoyl)-2-pyridinyl]thio]-1-oxoethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[5-(diethylsulfamoyl)pyridin-2-yl]sulfanylacetyl]amino]butanoate Traditional Name: 4-[[2-[[5-(diethylsulfamoyl)-2-pyridyl]thio]acetyl]amino]butyric acid ethyl ester Formula: C17H27N3O5S2 MolecularWeight: 417.54338

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CN=C(C=C1)SCC(=O)NCCCC(=O)OCC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CN=C(C=C1)SCC(=O)NCCCC(=O)OCC

InChI

InChI=1S/C17H27N3O5S2/c1-4-20(5-2)27(23,24)14-9-10-16(19-12-14)26-13-15(21)18-11-7-8-17(22)25-6-3/h9-10,12H,4-8,11,13H2,1-3H3,(H,18,21)