ethyl 3-[3-[1-(dimethylsulfamoyl)piperidin-3-yl]-5-oxidanylidene-4-thiophen-2-yl-1,2,4-triazol-1-yl]-2-oxidanylidene-propanoate

Systemtic Name: ethyl 3-[3-[1-(dimethylsulfamoyl)piperidin-3-yl]-5-oxidanylidene-4-thiophen-2-yl-1,2,4-triazol-1-yl]-2-oxidanylidene-propanoate Openeye Name: ethyl 3-[3-[1-(dimethylsulfamoyl)-3-piperidyl]-5-oxo-4-(2-thienyl)-1,2,4-triazol-1-yl]-2-oxo-propanoate CAS Name: 3-[3-[1-(dimethylsulfamoyl)-3-piperidinyl]-5-oxo-4-thiophen-2-yl-1,2,4-triazol-1-yl]-2-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-[3-[1-(dimethylsulfamoyl)piperidin-3-yl]-5-oxo-4-thiophen-2-yl-1,2,4-triazol-1-yl]-2-oxopropanoate Traditional Name: 3-[3-[1-(dimethylsulfamoyl)-3-piperidyl]-5-keto-4-(2-thienyl)-1,2,4-triazol-1-yl]-2-keto-propionic acid ethyl ester Formula: C18H25N5O6S2 MolecularWeight: 471.551

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)CN1C(=O)N(C(=N1)C2CCCN(C2)S(=O)(=O)N(C)C)C3=CC=CS3

Isomeric SMILES

CCOC(=O)C(=O)CN1C(=O)N(C(=N1)C2CCCN(C2)S(=O)(=O)N(C)C)C3=CC=CS3

InChI

InChI=1S/C18H25N5O6S2/c1-4-29-17(25)14(24)12-22-18(26)23(15-8-6-10-30-15)16(19-22)13-7-5-9-21(11-13)31(27,28)20(2)3/h6,8,10,13H,4-5,7,9,11-12H2,1-3H3