1-[2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]ethanoylamino]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]ethanoylamino]cyclohexane-1-carboxylic acid Openeye Name: 1-[[2-[(2-methylthiazol-4-yl)methylsulfanyl]acetyl]amino]cyclohexanecarboxylic acid CAS Name: 1-[[2-[(2-methyl-4-thiazolyl)methylthio]-1-oxoethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[[2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]acetyl]amino]cyclohexane-1-carboxylic acid Traditional Name: 1-[[2-[(2-methylthiazol-4-yl)methylthio]acetyl]amino]cyclohexanecarboxylic acid Formula: C14H20N2O3S2 MolecularWeight: 328.4502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CSCC(=O)NC2(CCCCC2)C(=O)O

Isomeric SMILES

CC1=NC(=CS1)CSCC(=O)NC2(CCCCC2)C(=O)O

InChI

InChI=1S/C14H20N2O3S2/c1-10-15-11(8-21-10)7-20-9-12(17)16-14(13(18)19)5-3-2-4-6-14/h8H,2-7,9H2,1H3,(H,16,17)(H,18,19)