methyl 2-[2-[(4,6-dimethoxypyrimidin-2-yl)methylsulfanyl]ethylcarbamoyl]cyclohexane-1-carboxylate

Systemtic Name: methyl 2-[2-[(4,6-dimethoxypyrimidin-2-yl)methylsulfanyl]ethylcarbamoyl]cyclohexane-1-carboxylate Openeye Name: methyl 2-[2-[(4,6-dimethoxypyrimidin-2-yl)methylsulfanyl]ethylcarbamoyl]cyclohexanecarboxylate CAS Name: 2-[[2-[(4,6-dimethoxy-2-pyrimidinyl)methylthio]ethylamino]-oxomethyl]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-[(4,6-dimethoxypyrimidin-2-yl)methylsulfanyl]ethylcarbamoyl]cyclohexane-1-carboxylate Traditional Name: 2-[2-[(4,6-dimethoxypyrimidin-2-yl)methylthio]ethylcarbamoyl]cyclohexanecarboxylic acid methyl ester Formula: C18H27N3O5S MolecularWeight: 397.48908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)CSCCNC(=O)C2CCCCC2C(=O)OC)OC

Isomeric SMILES

COC1=CC(=NC(=N1)CSCCNC(=O)C2CCCCC2C(=O)OC)OC

InChI

InChI=1S/C18H27N3O5S/c1-24-15-10-16(25-2)21-14(20-15)11-27-9-8-19-17(22)12-6-4-5-7-13(12)18(23)26-3/h10,12-13H,4-9,11H2,1-3H3,(H,19,22)