5-[2-(2,5-dimethylphenyl)sulfonylethylsulfanyl]-1-ethyl-1,2,3,4-tetrazole

Systemtic Name: 5-[2-(2,5-dimethylphenyl)sulfonylethylsulfanyl]-1-ethyl-1,2,3,4-tetrazole Openeye Name: 5-[2-(2,5-dimethylphenyl)sulfonylethylsulfanyl]-1-ethyl-tetrazole CAS Name: 5-[2-(2,5-dimethylphenyl)sulfonylethylthio]-1-ethyltetrazole IUPAC Name: 5-[2-(2,5-dimethylphenyl)sulfonylethylsulfanyl]-1-ethyltetrazole Traditional Name: 5-[2-(2,5-dimethylphenyl)sulfonylethylthio]-1-ethyl-tetrazole Formula: C13H18N4O2S2 MolecularWeight: 326.43762

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=N1)SCCS(=O)(=O)C2=C(C=CC(=C2)C)C

Isomeric SMILES

CCN1C(=NN=N1)SCCS(=O)(=O)C2=C(C=CC(=C2)C)C

InChI

InChI=1S/C13H18N4O2S2/c1-4-17-13(14-15-16-17)20-7-8-21(18,19)12-9-10(2)5-6-11(12)3/h5-6,9H,4,7-8H2,1-3H3