1-ethyl-5-[[4-(4-methylphenyl)sulfonylphenyl]methylsulfanyl]-1,2,3,4-tetrazole

Systemtic Name: 1-ethyl-5-[[4-(4-methylphenyl)sulfonylphenyl]methylsulfanyl]-1,2,3,4-tetrazole Openeye Name: 1-ethyl-5-[[4-(p-tolylsulfonyl)phenyl]methylsulfanyl]tetrazole CAS Name: 1-ethyl-5-[[4-(4-methylphenyl)sulfonylphenyl]methylthio]tetrazole IUPAC Name: 1-ethyl-5-[[4-(4-methylphenyl)sulfonylphenyl]methylsulfanyl]tetrazole Traditional Name: 1-ethyl-5-[(4-tosylbenzyl)thio]tetrazole Formula: C17H18N4O2S2 MolecularWeight: 374.48042

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=N1)SCC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCN1C(=NN=N1)SCC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C17H18N4O2S2/c1-3-21-17(18-19-20-21)24-12-14-6-10-16(11-7-14)25(22,23)15-8-4-13(2)5-9-15/h4-11H,3,12H2,1-2H3