2-ethyl-4-methyl-6-(2-pyrrolidin-1-ylethylsulfanyl)pyrimidine-5-carboxylic acid

Systemtic Name: 2-ethyl-4-methyl-6-(2-pyrrolidin-1-ylethylsulfanyl)pyrimidine-5-carboxylic acid Openeye Name: 2-ethyl-4-methyl-6-(2-pyrrolidin-1-ylethylsulfanyl)pyrimidine-5-carboxylic acid CAS Name: 2-ethyl-4-methyl-6-[2-(1-pyrrolidinyl)ethylthio]-5-pyrimidinecarboxylic acid IUPAC Name: 2-ethyl-4-methyl-6-(2-pyrrolidin-1-ylethylsulfanyl)pyrimidine-5-carboxylic acid Traditional Name: 2-ethyl-4-methyl-6-(2-pyrrolidinoethylthio)pyrimidine-5-carboxylic acid Formula: C14H21N3O2S MolecularWeight: 295.40044

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(C(=N1)SCCN2CCCC2)C(=O)O)C

Isomeric SMILES

CCC1=NC(=C(C(=N1)SCCN2CCCC2)C(=O)O)C

InChI

InChI=1S/C14H21N3O2S/c1-3-11-15-10(2)12(14(18)19)13(16-11)20-9-8-17-6-4-5-7-17/h3-9H2,1-2H3,(H,18,19)