1-tert-butyl-5-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-1,2,3,4-tetrazole

Systemtic Name: 1-tert-butyl-5-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-1,2,3,4-tetrazole Openeye Name: 1-tert-butyl-5-[2-(4-chlorophenyl)sulfonylethylsulfanyl]tetrazole CAS Name: 1-tert-butyl-5-[2-(4-chlorophenyl)sulfonylethylthio]tetrazole IUPAC Name: 1-tert-butyl-5-[2-(4-chlorophenyl)sulfonylethylsulfanyl]tetrazole Traditional Name: 1-tert-butyl-5-[2-(4-chlorophenyl)sulfonylethylthio]tetrazole Formula: C13H17ClN4O2S2 MolecularWeight: 360.88268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=NN=N1)SCCS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)N1C(=NN=N1)SCCS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H17ClN4O2S2/c1-13(2,3)18-12(15-16-17-18)21-8-9-22(19,20)11-6-4-10(14)5-7-11/h4-7H,8-9H2,1-3H3