4-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-2,6-dimethyl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-2,6-dimethyl-pyrimidine-5-carboxylic acid Openeye Name: 4-[(1-cyclopropyltetrazol-5-yl)methylsulfanyl]-2,6-dimethyl-pyrimidine-5-carboxylic acid CAS Name: 4-[(1-cyclopropyl-5-tetrazolyl)methylthio]-2,6-dimethyl-5-pyrimidinecarboxylic acid IUPAC Name: 4-[(1-cyclopropyltetrazol-5-yl)methylsulfanyl]-2,6-dimethylpyrimidine-5-carboxylic acid Traditional Name: 4-[(1-cyclopropyltetrazol-5-yl)methylthio]-2,6-dimethyl-pyrimidine-5-carboxylic acid Formula: C12H14N6O2S MolecularWeight: 306.34356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)SCC2=NN=NN2C3CC3)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)C)SCC2=NN=NN2C3CC3)C(=O)O

InChI

InChI=1S/C12H14N6O2S/c1-6-10(12(19)20)11(14-7(2)13-6)21-5-9-15-16-17-18(9)8-3-4-8/h8H,3-5H2,1-2H3,(H,19,20)