6-methyl-2-oxidanylidene-4-[(1-propyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 6-methyl-2-oxidanylidene-4-[(1-propyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-1H-pyrimidine-5-carboxylic acid Openeye Name: 6-methyl-2-oxo-4-[(1-propyltetrazol-5-yl)methylsulfanyl]-1H-pyrimidine-5-carboxylic acid CAS Name: 6-methyl-2-oxo-4-[(1-propyl-5-tetrazolyl)methylthio]-1H-pyrimidine-5-carboxylic acid IUPAC Name: 6-methyl-2-oxo-4-[(1-propyltetrazol-5-yl)methylsulfanyl]-1H-pyrimidine-5-carboxylic acid Traditional Name: 2-keto-6-methyl-4-[(1-propyltetrazol-5-yl)methylthio]-1H-pyrimidine-5-carboxylic acid Formula: C11H14N6O3S MolecularWeight: 310.33226

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)CSC2=NC(=O)NC(=C2C(=O)O)C

Isomeric SMILES

CCCN1C(=NN=N1)CSC2=NC(=O)NC(=C2C(=O)O)C

InChI

InChI=1S/C11H14N6O3S/c1-3-4-17-7(14-15-16-17)5-21-9-8(10(18)19)6(2)12-11(20)13-9/h3-5H2,1-2H3,(H,18,19)(H,12,13,20)