4-[[1-(4-dimethylaminophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]butanoic acid

Systemtic Name: 4-[[1-(4-dimethylaminophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]butanoic acid Openeye Name: 4-[1-(4-dimethylaminophenyl)tetrazol-5-yl]sulfanylbutanoic acid CAS Name: 4-[[1-(4-dimethylaminophenyl)-5-tetrazolyl]thio]butanoic acid IUPAC Name: 4-[1-(4-dimethylaminophenyl)tetrazol-5-yl]sulfanylbutanoic acid Traditional Name: 4-[[1-(4-dimethylaminophenyl)tetrazol-5-yl]thio]butyric acid Formula: C13H17N5O2S MolecularWeight: 307.37138

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)N2C(=NN=N2)SCCCC(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)N2C(=NN=N2)SCCCC(=O)O

InChI

InChI=1S/C13H17N5O2S/c1-17(2)10-5-7-11(8-6-10)18-13(14-15-16-18)21-9-3-4-12(19)20/h5-8H,3-4,9H2,1-2H3,(H,19,20)