[2-[2-cyanopropan-2-yl(methyl)amino]-2-oxidanylidene-ethyl] 2-chloranyl-5-(dimethylsulfamoyl)benzoate

Systemtic Name: [2-[2-cyanopropan-2-yl(methyl)amino]-2-oxidanylidene-ethyl] 2-chloranyl-5-(dimethylsulfamoyl)benzoate Openeye Name: [2-[(1-cyano-1-methyl-ethyl)-methyl-amino]-2-oxo-ethyl] 2-chloro-5-(dimethylsulfamoyl)benzoate CAS Name: 2-chloro-5-(dimethylsulfamoyl)benzoic acid [2-[2-cyanopropan-2-yl(methyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[2-cyanopropan-2-yl(methyl)amino]-2-oxoethyl] 2-chloro-5-(dimethylsulfamoyl)benzoate Traditional Name: 2-chloro-5-(dimethylsulfamoyl)benzoic acid [2-[(1-cyano-1-methyl-ethyl)-methyl-amino]-2-keto-ethyl] ester Formula: C16H20ClN3O5S MolecularWeight: 401.8651

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)N(C)C(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N(C)C)Cl

Isomeric SMILES

CC(C)(C#N)N(C)C(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N(C)C)Cl

InChI

InChI=1S/C16H20ClN3O5S/c1-16(2,10-18)20(5)14(21)9-25-15(22)12-8-11(6-7-13(12)17)26(23,24)19(3)4/h6-8H,9H2,1-5H3