ethyl 4-[(2S)-3-methyl-2-(phenylsulfonylamino)butanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(2S)-3-methyl-2-(phenylsulfonylamino)butanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(2S)-2-(benzenesulfonamido)-3-methyl-butanoyl]piperazine-1-carboxylate CAS Name: 4-[(2S)-2-(benzenesulfonamido)-3-methyl-1-oxobutyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2S)-2-(benzenesulfonamido)-3-methylbutanoyl]piperazine-1-carboxylate Traditional Name: 4-[(2S)-2-(benzenesulfonamido)-3-methyl-butanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H27N3O5S MolecularWeight: 397.48908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(C(C)C)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)[C@H](C(C)C)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H27N3O5S/c1-4-26-18(23)21-12-10-20(11-13-21)17(22)16(14(2)3)19-27(24,25)15-8-6-5-7-9-15/h5-9,14,16,19H,4,10-13H2,1-3H3/t16-/m0/s1