1-(2-methylpropyl)-5-[2-(phenylsulfinyl)ethylsulfanyl]-1,2,3,4-tetrazole

Systemtic Name: 1-(2-methylpropyl)-5-[2-(phenylsulfinyl)ethylsulfanyl]-1,2,3,4-tetrazole Openeye Name: 5-[2-(benzenesulfinyl)ethylsulfanyl]-1-isobutyl-tetrazole CAS Name: 5-[2-(benzenesulfinyl)ethylthio]-1-(2-methylpropyl)tetrazole IUPAC Name: 5-[2-(benzenesulfinyl)ethylsulfanyl]-1-(2-methylpropyl)tetrazole Traditional Name: 5-[2-(benzenesulfinyl)ethylthio]-1-isobutyl-tetrazole Formula: C13H18N4OS2 MolecularWeight: 310.43822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=N1)SCCS(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)CN1C(=NN=N1)SCCS(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H18N4OS2/c1-11(2)10-17-13(14-15-16-17)19-8-9-20(18)12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3