4-methyl-1-[(2-methylsulfanylpyridin-3-yl)carbonylamino]cyclohexane-1-carboxylic acid

Systemtic Name: 4-methyl-1-[(2-methylsulfanylpyridin-3-yl)carbonylamino]cyclohexane-1-carboxylic acid Openeye Name: 4-methyl-1-[(2-methylsulfanylpyridine-3-carbonyl)amino]cyclohexanecarboxylic acid CAS Name: 4-methyl-1-[[[2-(methylthio)-3-pyridinyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-methyl-1-[(2-methylsulfanylpyridine-3-carbonyl)amino]cyclohexane-1-carboxylic acid Traditional Name: 4-methyl-1-[[2-(methylthio)nicotinoyl]amino]cyclohexanecarboxylic acid Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C(=O)O)NC(=O)C2=C(N=CC=C2)SC

Isomeric SMILES

CC1CCC(CC1)(C(=O)O)NC(=O)C2=C(N=CC=C2)SC

InChI

InChI=1S/C15H20N2O3S/c1-10-5-7-15(8-6-10,14(19)20)17-12(18)11-4-3-9-16-13(11)21-2/h3-4,9-10H,5-8H2,1-2H3,(H,17,18)(H,19,20)