(4-chloranyl-5-methyl-2-propan-2-yl-phenyl) 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoate

Systemtic Name: (4-chloranyl-5-methyl-2-propan-2-yl-phenyl) 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoate Openeye Name: (4-chloro-2-isopropyl-5-methyl-phenyl) 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoate CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]propanoic acid (4-chloro-5-methyl-2-propan-2-ylphenyl) ester IUPAC Name: (4-chloro-5-methyl-2-propan-2-ylphenyl) 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoate Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]propionic acid (4-chloro-2-isopropyl-5-methyl-phenyl) ester Formula: C20H25ClN2O2S MolecularWeight: 392.9427

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C(C)C)OC(=O)CCC2=C(N=C(N=C2C)SC)C

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C(C)C)OC(=O)CCC2=C(N=C(N=C2C)SC)C

InChI

InChI=1S/C20H25ClN2O2S/c1-11(2)16-10-17(21)12(3)9-18(16)25-19(24)8-7-15-13(4)22-20(26-6)23-14(15)5/h9-11H,7-8H2,1-6H3