(4-methyl-3-bicyclo[2.2.0]hexanyl) 2-(5-methylpyrimidin-2-yl)sulfanylethanoate

Systemtic Name: (4-methyl-3-bicyclo[2.2.0]hexanyl) 2-(5-methylpyrimidin-2-yl)sulfanylethanoate Openeye Name: (4-methyl-3-bicyclo[2.2.0]hexanyl) 2-(5-methylpyrimidin-2-yl)sulfanylacetate CAS Name: 2-[(5-methyl-2-pyrimidinyl)thio]acetic acid (4-methyl-3-bicyclo[2.2.0]hexanyl) ester IUPAC Name: (4-methyl-3-bicyclo[2.2.0]hexanyl) 2-(5-methylpyrimidin-2-yl)sulfanylacetate Traditional Name: 2-[(5-methylpyrimidin-2-yl)thio]acetic acid (4-methyl-3-bicyclo[2.2.0]hexanyl) ester Formula: C14H18N2O2S MolecularWeight: 278.36992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1)SCC(=O)OC2CC3C2(CC3)C

Isomeric SMILES

CC1=CN=C(N=C1)SCC(=O)OC2CC3C2(CC3)C

InChI

InChI=1S/C14H18N2O2S/c1-9-6-15-13(16-7-9)19-8-12(17)18-11-5-10-3-4-14(10,11)2/h6-7,10-11H,3-5,8H2,1-2H3