2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylsulfonyl]quinoline

Systemtic Name: 2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylsulfonyl]quinoline Openeye Name: 2-(1-phenyltetrazol-5-yl)sulfanylsulfonylquinoline CAS Name: 2-[(1-phenyl-5-tetrazolyl)thio]sulfonylquinoline IUPAC Name: 2-(1-phenyltetrazol-5-yl)sulfanylsulfonylquinoline Traditional Name: 2-[(1-phenyltetrazol-5-yl)thio]sulfonylquinoline Formula: C16H11N5O2S2 MolecularWeight: 369.42084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SS(=O)(=O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SS(=O)(=O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C16H11N5O2S2/c22-25(23,15-11-10-12-6-4-5-9-14(12)17-15)24-16-18-19-20-21(16)13-7-2-1-3-8-13/h1-11H