3-methyl-4-phenyl-5-[tris(bromanyl)methylsulfonyl]-1,2,4-triazole

Systemtic Name: 3-methyl-4-phenyl-5-[tris(bromanyl)methylsulfonyl]-1,2,4-triazole Openeye Name: 3-methyl-4-phenyl-5-(tribromomethylsulfonyl)-1,2,4-triazole CAS Name: 3-methyl-4-phenyl-5-(tribromomethylsulfonyl)-1,2,4-triazole IUPAC Name: 3-methyl-4-phenyl-5-(tribromomethylsulfonyl)-1,2,4-triazole Traditional Name: 3-methyl-4-phenyl-5-(tribromomethylsulfonyl)-1,2,4-triazole Formula: C10H8Br3N3O2S MolecularWeight: 473.96642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC=C2)S(=O)(=O)C(Br)(Br)Br

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2)S(=O)(=O)C(Br)(Br)Br

InChI

InChI=1S/C10H8Br3N3O2S/c1-7-14-15-9(19(17,18)10(11,12)13)16(7)8-5-3-2-4-6-8/h2-6H,1H3