4-butylsulfanyl-2,6-dimethyl-pyrimidine-5-carboxylate

Systemtic Name: 4-butylsulfanyl-2,6-dimethyl-pyrimidine-5-carboxylate Openeye Name: 4-butylsulfanyl-2,6-dimethyl-pyrimidine-5-carboxylate CAS Name: 4-(butylthio)-2,6-dimethyl-5-pyrimidinecarboxylate IUPAC Name: 4-butylsulfanyl-2,6-dimethylpyrimidine-5-carboxylate Traditional Name: 4-(butylthio)-2,6-dimethyl-pyrimidine-5-carboxylate Formula: C11H15N2O2S- MolecularWeight: 239.314

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(=NC(=C1C(=O)[O-])C)C

Isomeric SMILES

CCCCSC1=NC(=NC(=C1C(=O)[O-])C)C

InChI

InChI=1S/C11H16N2O2S/c1-4-5-6-16-10-9(11(14)15)7(2)12-8(3)13-10/h4-6H2,1-3H3,(H,14,15)/p-1