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

Systemtic Name: ethyl 4-[3-[1-(dimethylsulfamoyl)piperidin-4-yl]-5-oxidanylidene-4-thiophen-2-yl-1,2,4-triazol-1-yl]-3-oxidanylidene-butanoate Openeye Name: ethyl 4-[3-[1-(dimethylsulfamoyl)-4-piperidyl]-5-oxo-4-(2-thienyl)-1,2,4-triazol-1-yl]-3-oxo-butanoate CAS Name: 4-[3-[1-(dimethylsulfamoyl)-4-piperidinyl]-5-oxo-4-thiophen-2-yl-1,2,4-triazol-1-yl]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[3-[1-(dimethylsulfamoyl)piperidin-4-yl]-5-oxo-4-thiophen-2-yl-1,2,4-triazol-1-yl]-3-oxobutanoate Traditional Name: 4-[3-[1-(dimethylsulfamoyl)-4-piperidyl]-5-keto-4-(2-thienyl)-1,2,4-triazol-1-yl]-3-keto-butyric acid ethyl ester Formula: C19H27N5O6S2 MolecularWeight: 485.57758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CN1C(=O)N(C(=N1)C2CCN(CC2)S(=O)(=O)N(C)C)C3=CC=CS3

Isomeric SMILES

CCOC(=O)CC(=O)CN1C(=O)N(C(=N1)C2CCN(CC2)S(=O)(=O)N(C)C)C3=CC=CS3

InChI

InChI=1S/C19H27N5O6S2/c1-4-30-17(26)12-15(25)13-23-19(27)24(16-6-5-11-31-16)18(20-23)14-7-9-22(10-8-14)32(28,29)21(2)3/h5-6,11,14H,4,7-10,12-13H2,1-3H3