methyl 3,3-bis[(4,6-dimethylpyrimidin-2-yl)sulfanyl]propanoate

Systemtic Name: methyl 3,3-bis[(4,6-dimethylpyrimidin-2-yl)sulfanyl]propanoate Openeye Name: methyl 3,3-bis[(4,6-dimethylpyrimidin-2-yl)sulfanyl]propanoate CAS Name: 3,3-bis[(4,6-dimethyl-2-pyrimidinyl)thio]propanoic acid methyl ester IUPAC Name: methyl 3,3-bis[(4,6-dimethylpyrimidin-2-yl)sulfanyl]propanoate Traditional Name: 3,3-bis[(4,6-dimethylpyrimidin-2-yl)thio]propionic acid methyl ester Formula: C16H20N4O2S2 MolecularWeight: 364.4856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC(CC(=O)OC)SC2=NC(=CC(=N2)C)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC(CC(=O)OC)SC2=NC(=CC(=N2)C)C)C

InChI

InChI=1S/C16H20N4O2S2/c1-9-6-10(2)18-15(17-9)23-14(8-13(21)22-5)24-16-19-11(3)7-12(4)20-16/h6-7,14H,8H2,1-5H3