1-methyl-5-(4-phenylsulfanylbutylsulfanyl)-1,2,3,4-tetrazole

Systemtic Name: 1-methyl-5-(4-phenylsulfanylbutylsulfanyl)-1,2,3,4-tetrazole Openeye Name: 1-methyl-5-(4-phenylsulfanylbutylsulfanyl)tetrazole CAS Name: 1-methyl-5-[4-(phenylthio)butylthio]tetrazole IUPAC Name: 1-methyl-5-(4-phenylsulfanylbutylsulfanyl)tetrazole Traditional Name: 1-methyl-5-[4-(phenylthio)butylthio]tetrazole Formula: C12H16N4S2 MolecularWeight: 280.41224

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCCCCSC2=CC=CC=C2

Isomeric SMILES

CN1C(=NN=N1)SCCCCSC2=CC=CC=C2

InChI

InChI=1S/C12H16N4S2/c1-16-12(13-14-15-16)18-10-6-5-9-17-11-7-3-2-4-8-11/h2-4,7-8H,5-6,9-10H2,1H3