5-(4-bromanyl-2-nitro-phenyl)sulfanyl-1-(4-methylphenyl)-1,2,3,4-tetrazole

Systemtic Name: 5-(4-bromanyl-2-nitro-phenyl)sulfanyl-1-(4-methylphenyl)-1,2,3,4-tetrazole Openeye Name: 5-(4-bromo-2-nitro-phenyl)sulfanyl-1-(p-tolyl)tetrazole CAS Name: 5-[(4-bromo-2-nitrophenyl)thio]-1-(4-methylphenyl)tetrazole IUPAC Name: 5-(4-bromo-2-nitrophenyl)sulfanyl-1-(4-methylphenyl)tetrazole Traditional Name: 5-[(4-bromo-2-nitro-phenyl)thio]-1-(p-tolyl)tetrazole Formula: C14H10BrN5O2S MolecularWeight: 392.2305

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10BrN5O2S/c1-9-2-5-11(6-3-9)19-14(16-17-18-19)23-13-7-4-10(15)8-12(13)20(21)22/h2-8H,1H3