3-[[1-(2-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]propylazanium

Systemtic Name: 3-[[1-(2-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]propylazanium Openeye Name: 3-[1-(o-tolyl)tetrazol-5-yl]sulfanylpropylammonium CAS Name: 3-[[1-(2-methylphenyl)-5-tetrazolyl]thio]propylammonium IUPAC Name: 3-[1-(2-methylphenyl)tetrazol-5-yl]sulfanylpropylazanium Traditional Name: 3-[[1-(o-tolyl)tetrazol-5-yl]thio]propylammonium Formula: C11H16N5S+ MolecularWeight: 250.34324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=N2)SCCC[NH3+]

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=N2)SCCC[NH3+]

InChI

InChI=1S/C11H15N5S/c1-9-5-2-3-6-10(9)16-11(13-14-15-16)17-8-4-7-12/h2-3,5-6H,4,7-8,12H2,1H3/p+1