1-(2-butylsulfanylethanoylamino)-4-methyl-cyclohexane-1-carboxylic acid

Systemtic Name: 1-(2-butylsulfanylethanoylamino)-4-methyl-cyclohexane-1-carboxylic acid Openeye Name: 1-[(2-butylsulfanylacetyl)amino]-4-methyl-cyclohexanecarboxylic acid CAS Name: 1-[[2-(butylthio)-1-oxoethyl]amino]-4-methyl-1-cyclohexanecarboxylic acid IUPAC Name: 1-[(2-butylsulfanylacetyl)amino]-4-methylcyclohexane-1-carboxylic acid Traditional Name: 1-[[2-(butylthio)acetyl]amino]-4-methyl-cyclohexanecarboxylic acid Formula: C14H25NO3S MolecularWeight: 287.4182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC(=O)NC1(CCC(CC1)C)C(=O)O

Isomeric SMILES

CCCCSCC(=O)NC1(CCC(CC1)C)C(=O)O

InChI

InChI=1S/C14H25NO3S/c1-3-4-9-19-10-12(16)15-14(13(17)18)7-5-11(2)6-8-14/h11H,3-10H2,1-2H3,(H,15,16)(H,17,18)