methyl 2-[2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[(4-tert-butyl-2,6-dimethylphenyl)methylthio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[2-[(4-tert-butyl-2,6-dimethyl-benzyl)thio]-4-keto-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C20H26N2O3S MolecularWeight: 374.49704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CSC2=NC(=O)C=C(N2)CC(=O)OC)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CSC2=NC(=O)C=C(N2)CC(=O)OC)C)C(C)(C)C

InChI

InChI=1S/C20H26N2O3S/c1-12-7-14(20(3,4)5)8-13(2)16(12)11-26-19-21-15(9-17(23)22-19)10-18(24)25-6/h7-9H,10-11H2,1-6H3,(H,21,22,23)