methyl 2-[[5-(2,2-dimethylpropylcarbamoyl)-2-(methylamino)phenyl]sulfonyl-methyl-amino]ethanoate

Systemtic Name: methyl 2-[[5-(2,2-dimethylpropylcarbamoyl)-2-(methylamino)phenyl]sulfonyl-methyl-amino]ethanoate Openeye Name: methyl 2-[[5-(2,2-dimethylpropylcarbamoyl)-2-(methylamino)phenyl]sulfonyl-methyl-amino]acetate CAS Name: 2-[[5-[(2,2-dimethylpropylamino)-oxomethyl]-2-(methylamino)phenyl]sulfonyl-methylamino]acetic acid methyl ester IUPAC Name: methyl 2-[[5-(2,2-dimethylpropylcarbamoyl)-2-(methylamino)phenyl]sulfonyl-methylamino]acetate Traditional Name: 2-[methyl-[2-(methylamino)-5-(neopentylcarbamoyl)phenyl]sulfonyl-amino]acetic acid methyl ester Formula: C17H27N3O5S MolecularWeight: 385.47838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNC(=O)C1=CC(=C(C=C1)NC)S(=O)(=O)N(C)CC(=O)OC

Isomeric SMILES

CC(C)(C)CNC(=O)C1=CC(=C(C=C1)NC)S(=O)(=O)N(C)CC(=O)OC

InChI

InChI=1S/C17H27N3O5S/c1-17(2,3)11-19-16(22)12-7-8-13(18-4)14(9-12)26(23,24)20(5)10-15(21)25-6/h7-9,18H,10-11H2,1-6H3,(H,19,22)