cyanomethyl 2-[[3-(diethylsulfamoyl)phenyl]carbonylamino]-3-methyl-butanoate

Systemtic Name: cyanomethyl 2-[[3-(diethylsulfamoyl)phenyl]carbonylamino]-3-methyl-butanoate Openeye Name: cyanomethyl 2-[[3-(diethylsulfamoyl)benzoyl]amino]-3-methyl-butanoate CAS Name: 2-[[[3-(diethylsulfamoyl)phenyl]-oxomethyl]amino]-3-methylbutanoic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-[[3-(diethylsulfamoyl)benzoyl]amino]-3-methylbutanoate Traditional Name: 2-[[3-(diethylsulfamoyl)benzoyl]amino]-3-methyl-butyric acid cyanomethyl ester Formula: C18H25N3O5S MolecularWeight: 395.4732

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NC(C(C)C)C(=O)OCC#N

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NC(C(C)C)C(=O)OCC#N

InChI

InChI=1S/C18H25N3O5S/c1-5-21(6-2)27(24,25)15-9-7-8-14(12-15)17(22)20-16(13(3)4)18(23)26-11-10-19/h7-9,12-13,16H,5-6,11H2,1-4H3,(H,20,22)