2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3,3-dimethyl-pentanal

Systemtic Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3,3-dimethyl-pentanal Openeye Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3,3-dimethyl-pentanal CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)thio]-3,3-dimethylpentanal IUPAC Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3,3-dimethylpentanal Traditional Name: 2-[(4,6-dimethoxypyrimidin-2-yl)thio]-3,3-dimethyl-valeraldehyde Formula: C13H20N2O3S MolecularWeight: 284.3745

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(C=O)SC1=NC(=CC(=N1)OC)OC

Isomeric SMILES

CCC(C)(C)C(C=O)SC1=NC(=CC(=N1)OC)OC

InChI

InChI=1S/C13H20N2O3S/c1-6-13(2,3)9(8-16)19-12-14-10(17-4)7-11(15-12)18-5/h7-9H,6H2,1-5H3