2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)sulfanyl]-3-ethoxy-3-methyl-butanoic acid

Systemtic Name: 2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)sulfanyl]-3-ethoxy-3-methyl-butanoic acid Openeye Name: 2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)sulfanyl]-3-ethoxy-3-methyl-butanoic acid CAS Name: 2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)thio]-3-ethoxy-3-methylbutanoic acid IUPAC Name: 2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)sulfanyl]-3-ethoxy-3-methylbutanoic acid Traditional Name: 2-[(4,6-dimethoxy-s-triazin-2-yl)thio]-3-ethoxy-3-methyl-butyric acid Formula: C12H19N3O5S MolecularWeight: 317.36136

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C)(C)C(C(=O)O)SC1=NC(=NC(=N1)OC)OC

Isomeric SMILES

CCOC(C)(C)C(C(=O)O)SC1=NC(=NC(=N1)OC)OC

InChI

InChI=1S/C12H19N3O5S/c1-6-20-12(2,3)7(8(16)17)21-11-14-9(18-4)13-10(15-11)19-5/h7H,6H2,1-5H3,(H,16,17)