5-[4-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]butanoyl]furan-2-carboxylic acid

Systemtic Name: 5-[4-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]butanoyl]furan-2-carboxylic acid Openeye Name: 5-[4-(1-methyltetrazol-5-yl)sulfanylbutanoyl]furan-2-carboxylic acid CAS Name: 5-[4-[(1-methyl-5-tetrazolyl)thio]-1-oxobutyl]-2-furancarboxylic acid IUPAC Name: 5-[4-(1-methyltetrazol-5-yl)sulfanylbutanoyl]furan-2-carboxylic acid Traditional Name: 5-[4-[(1-methyltetrazol-5-yl)thio]butanoyl]-2-furoic acid Formula: C11H12N4O4S MolecularWeight: 296.30238

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCCCC(=O)C2=CC=C(O2)C(=O)O

Isomeric SMILES

CN1C(=NN=N1)SCCCC(=O)C2=CC=C(O2)C(=O)O

InChI

InChI=1S/C11H12N4O4S/c1-15-11(12-13-14-15)20-6-2-3-7(16)8-4-5-9(19-8)10(17)18/h4-5H,2-3,6H2,1H3,(H,17,18)