1-(4-nitrosulfanylphenyl)-5-(2-phenylpropan-2-ylsulfanyl)-1,2,3,4-tetrazole

Systemtic Name: 1-(4-nitrosulfanylphenyl)-5-(2-phenylpropan-2-ylsulfanyl)-1,2,3,4-tetrazole Openeye Name: 5-(1-methyl-1-phenyl-ethyl)sulfanyl-1-(4-nitrosulfanylphenyl)tetrazole CAS Name: 1-[4-(nitrothio)phenyl]-5-(2-phenylpropan-2-ylthio)tetrazole IUPAC Name: 1-(4-nitrosulfanylphenyl)-5-(2-phenylpropan-2-ylsulfanyl)tetrazole Traditional Name: 5-(cumylthio)-1-[4-(nitrothio)phenyl]tetrazole Formula: C16H15N5O2S2 MolecularWeight: 373.4526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)SC2=NN=NN2C3=CC=C(C=C3)S[N+](=O)[O-]

Isomeric SMILES

CC(C)(C1=CC=CC=C1)SC2=NN=NN2C3=CC=C(C=C3)S[N+](=O)[O-]

InChI

InChI=1S/C16H15N5O2S2/c1-16(2,12-6-4-3-5-7-12)24-15-17-18-19-20(15)13-8-10-14(11-9-13)25-21(22)23/h3-11H,1-2H3