4-methyl-1-(2-propan-2-ylsulfanylethanoylamino)cyclohexane-1-carboxylic acid

Systemtic Name: 4-methyl-1-(2-propan-2-ylsulfanylethanoylamino)cyclohexane-1-carboxylic acid Openeye Name: 1-[(2-isopropylsulfanylacetyl)amino]-4-methyl-cyclohexanecarboxylic acid CAS Name: 4-methyl-1-[[1-oxo-2-(propan-2-ylthio)ethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-methyl-1-[(2-propan-2-ylsulfanylacetyl)amino]cyclohexane-1-carboxylic acid Traditional Name: 1-[[2-(isopropylthio)acetyl]amino]-4-methyl-cyclohexanecarboxylic acid Formula: C13H23NO3S MolecularWeight: 273.39162

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C(=O)O)NC(=O)CSC(C)C

Isomeric SMILES

CC1CCC(CC1)(C(=O)O)NC(=O)CSC(C)C

InChI

InChI=1S/C13H23NO3S/c1-9(2)18-8-11(15)14-13(12(16)17)6-4-10(3)5-7-13/h9-10H,4-8H2,1-3H3,(H,14,15)(H,16,17)