1-(2,6-dimethylphenyl)-5-(4-fluoranyl-2-nitro-phenyl)sulfanyl-1,2,3,4-tetrazole

Systemtic Name: 1-(2,6-dimethylphenyl)-5-(4-fluoranyl-2-nitro-phenyl)sulfanyl-1,2,3,4-tetrazole Openeye Name: 1-(2,6-dimethylphenyl)-5-(4-fluoro-2-nitro-phenyl)sulfanyl-tetrazole CAS Name: 1-(2,6-dimethylphenyl)-5-[(4-fluoro-2-nitrophenyl)thio]tetrazole IUPAC Name: 1-(2,6-dimethylphenyl)-5-(4-fluoro-2-nitrophenyl)sulfanyltetrazole Traditional Name: 1-(2,6-dimethylphenyl)-5-[(4-fluoro-2-nitro-phenyl)thio]tetrazole Formula: C15H12FN5O2S MolecularWeight: 345.351483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=NN=N2)SC3=C(C=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=NN=N2)SC3=C(C=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C15H12FN5O2S/c1-9-4-3-5-10(2)14(9)20-15(17-18-19-20)24-13-7-6-11(16)8-12(13)21(22)23/h3-8H,1-2H3