5-[[3-(4-methylsulfanylphenyl)-1H-pyrazol-5-yl]methyl]-2H-1,2,3,4-tetrazole

Systemtic Name: 5-[[3-(4-methylsulfanylphenyl)-1H-pyrazol-5-yl]methyl]-2H-1,2,3,4-tetrazole Openeye Name: 5-[[3-(4-methylsulfanylphenyl)-1H-pyrazol-5-yl]methyl]-2H-tetrazole CAS Name: 5-[[3-[4-(methylthio)phenyl]-1H-pyrazol-5-yl]methyl]-2H-tetrazole IUPAC Name: 5-[[3-(4-methylsulfanylphenyl)-1H-pyrazol-5-yl]methyl]-2H-tetrazole Traditional Name: 5-[[3-[4-(methylthio)phenyl]-1H-pyrazol-5-yl]methyl]-2H-tetrazole Formula: C12H12N6S MolecularWeight: 272.32888

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=NNC(=C2)CC3=NNN=N3

Isomeric SMILES

CSC1=CC=C(C=C1)C2=NNC(=C2)CC3=NNN=N3

InChI

InChI=1S/C12H12N6S/c1-19-10-4-2-8(3-5-10)11-6-9(13-14-11)7-12-15-17-18-16-12/h2-6H,7H2,1H3,(H,13,14)(H,15,16,17,18)