2-cyclopropyl-4-(1,3-dioxan-4-ylmethylsulfanyl)-6-methyl-pyrimidine-5-carboxylic acid

Systemtic Name: 2-cyclopropyl-4-(1,3-dioxan-4-ylmethylsulfanyl)-6-methyl-pyrimidine-5-carboxylic acid Openeye Name: 2-cyclopropyl-4-(1,3-dioxan-4-ylmethylsulfanyl)-6-methyl-pyrimidine-5-carboxylic acid CAS Name: 2-cyclopropyl-4-(1,3-dioxan-4-ylmethylthio)-6-methyl-5-pyrimidinecarboxylic acid IUPAC Name: 2-cyclopropyl-4-(1,3-dioxan-4-ylmethylsulfanyl)-6-methylpyrimidine-5-carboxylic acid Traditional Name: 2-cyclopropyl-4-(1,3-dioxan-4-ylmethylthio)-6-methyl-pyrimidine-5-carboxylic acid Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2CC2)SCC3CCOCO3)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)C2CC2)SCC3CCOCO3)C(=O)O

InChI

InChI=1S/C14H18N2O4S/c1-8-11(14(17)18)13(16-12(15-8)9-2-3-9)21-6-10-4-5-19-7-20-10/h9-10H,2-7H2,1H3,(H,17,18)