[2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 3-[4-(diethylsulfamoyl)phenyl]propanoate

Systemtic Name: [2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 3-[4-(diethylsulfamoyl)phenyl]propanoate Openeye Name: [2-(butylcarbamoylamino)-2-oxo-ethyl] 3-[4-(diethylsulfamoyl)phenyl]propanoate CAS Name: 3-[4-(diethylsulfamoyl)phenyl]propanoic acid [2-[[butylamino(oxo)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(butylcarbamoylamino)-2-oxoethyl] 3-[4-(diethylsulfamoyl)phenyl]propanoate Traditional Name: 3-[4-(diethylsulfamoyl)phenyl]propionic acid [2-(butylcarbamoylamino)-2-keto-ethyl] ester Formula: C20H31N3O6S MolecularWeight: 441.54164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)COC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N(CC)CC

Isomeric SMILES

CCCCNC(=O)NC(=O)COC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N(CC)CC

InChI

InChI=1S/C20H31N3O6S/c1-4-7-14-21-20(26)22-18(24)15-29-19(25)13-10-16-8-11-17(12-9-16)30(27,28)23(5-2)6-3/h8-9,11-12H,4-7,10,13-15H2,1-3H3,(H2,21,22,24,26)