4-methylsulfonyl-2-(2-propan-2-ylsulfanylethanoylamino)butanoic acid

Systemtic Name: 4-methylsulfonyl-2-(2-propan-2-ylsulfanylethanoylamino)butanoic acid Openeye Name: 2-[(2-isopropylsulfanylacetyl)amino]-4-methylsulfonyl-butanoic acid CAS Name: 4-methylsulfonyl-2-[[1-oxo-2-(propan-2-ylthio)ethyl]amino]butanoic acid IUPAC Name: 4-methylsulfonyl-2-[(2-propan-2-ylsulfanylacetyl)amino]butanoic acid Traditional Name: 2-[[2-(isopropylthio)acetyl]amino]-4-mesyl-butyric acid Formula: C10H19NO5S2 MolecularWeight: 297.39156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCC(=O)NC(CCS(=O)(=O)C)C(=O)O

Isomeric SMILES

CC(C)SCC(=O)NC(CCS(=O)(=O)C)C(=O)O

InChI

InChI=1S/C10H19NO5S2/c1-7(2)17-6-9(12)11-8(10(13)14)4-5-18(3,15)16/h7-8H,4-6H2,1-3H3,(H,11,12)(H,13,14)