methyl 4-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoyloxy]benzoate

Systemtic Name: methyl 4-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoyloxy]benzoate Openeye Name: methyl 4-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]oxybenzoate CAS Name: 4-[2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]oxybenzoate Traditional Name: 4-[2-[(4,6-dimethylpyrimidin-2-yl)thio]acetyl]oxybenzoic acid methyl ester Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)OC2=CC=C(C=C2)C(=O)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)OC2=CC=C(C=C2)C(=O)OC)C

InChI

InChI=1S/C16H16N2O4S/c1-10-8-11(2)18-16(17-10)23-9-14(19)22-13-6-4-12(5-7-13)15(20)21-3/h4-8H,9H2,1-3H3