[2-(methylcarbamothioyl)-1-oxidanyl-2-pyridin-3-yl-cyclohexyl] ethanoate

Systemtic Name: [2-(methylcarbamothioyl)-1-oxidanyl-2-pyridin-3-yl-cyclohexyl] ethanoate Openeye Name: [1-hydroxy-2-(methylcarbamothioyl)-2-(3-pyridyl)cyclohexyl] acetate CAS Name: acetic acid [1-hydroxy-2-[methylamino(sulfanylidene)methyl]-2-(3-pyridinyl)cyclohexyl] ester IUPAC Name: [1-hydroxy-2-(methylcarbamothioyl)-2-pyridin-3-ylcyclohexyl] acetate Traditional Name: acetic acid [1-hydroxy-2-(methylthiocarbamoyl)-2-(3-pyridyl)cyclohexyl] ester Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(CCCCC1(C2=CN=CC=C2)C(=S)NC)O

Isomeric SMILES

CC(=O)OC1(CCCCC1(C2=CN=CC=C2)C(=S)NC)O

InChI

InChI=1S/C15H20N2O3S/c1-11(18)20-15(19)8-4-3-7-14(15,13(21)16-2)12-6-5-9-17-10-12/h5-6,9-10,19H,3-4,7-8H2,1-2H3,(H,16,21)