[2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-3-oxidanylidene-cyclopentyl]methyl ethanoate

Systemtic Name: [2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-3-oxidanylidene-cyclopentyl]methyl ethanoate Openeye Name: [2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-3-oxo-cyclopentyl]methyl acetate CAS Name: acetic acid [2-[[(4-methyl-2-pyrimidinyl)thio]methyl]-3-oxocyclopentyl]methyl ester IUPAC Name: [2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-3-oxocyclopentyl]methyl acetate Traditional Name: acetic acid [3-keto-2-[[(4-methylpyrimidin-2-yl)thio]methyl]cyclopentyl]methyl ester Formula: C14H18N2O3S MolecularWeight: 294.36932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SCC2C(CCC2=O)COC(=O)C

Isomeric SMILES

CC1=NC(=NC=C1)SCC2C(CCC2=O)COC(=O)C

InChI

InChI=1S/C14H18N2O3S/c1-9-5-6-15-14(16-9)20-8-12-11(3-4-13(12)18)7-19-10(2)17/h5-6,11-12H,3-4,7-8H2,1-2H3