(2S)-4-methylsulfonyl-2-(phenylcarbamoylamino)butanoate

Systemtic Name: (2S)-4-methylsulfonyl-2-(phenylcarbamoylamino)butanoate Openeye Name: (2S)-4-methylsulfonyl-2-(phenylcarbamoylamino)butanoate CAS Name: (2S)-2-[[anilino(oxo)methyl]amino]-4-methylsulfonylbutanoate IUPAC Name: (2S)-4-methylsulfonyl-2-(phenylcarbamoylamino)butanoate Traditional Name: (2S)-4-mesyl-2-(phenylcarbamoylamino)butyrate Formula: C12H15N2O5S- MolecularWeight: 299.3229

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)[O-])NC(=O)NC1=CC=CC=C1

Isomeric SMILES

CS(=O)(=O)CC[C@@H](C(=O)[O-])NC(=O)NC1=CC=CC=C1

InChI

InChI=1S/C12H16N2O5S/c1-20(18,19)8-7-10(11(15)16)14-12(17)13-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3,(H,15,16)(H2,13,14,17)/p-1/t10-/m0/s1