methyl 2-[4-[3,5-bis(chloranyl)phenyl]pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: methyl 2-[4-[3,5-bis(chloranyl)phenyl]pyrimidin-2-yl]sulfanylethanoate Openeye Name: methyl 2-[4-(3,5-dichlorophenyl)pyrimidin-2-yl]sulfanylacetate CAS Name: 2-[[4-(3,5-dichlorophenyl)-2-pyrimidinyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[4-(3,5-dichlorophenyl)pyrimidin-2-yl]sulfanylacetate Traditional Name: 2-[[4-(3,5-dichlorophenyl)pyrimidin-2-yl]thio]acetic acid methyl ester Formula: C13H10Cl2N2O2S MolecularWeight: 329.2017

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC=CC(=N1)C2=CC(=CC(=C2)Cl)Cl

Isomeric SMILES

COC(=O)CSC1=NC=CC(=N1)C2=CC(=CC(=C2)Cl)Cl

InChI

InChI=1S/C13H10Cl2N2O2S/c1-19-12(18)7-20-13-16-3-2-11(17-13)8-4-9(14)6-10(15)5-8/h2-6H,7H2,1H3