3-[4-phenyl-5-[tris(bromanyl)methylsulfonyl]-1,2,4-triazol-3-yl]benzaldehyde

Systemtic Name: 3-[4-phenyl-5-[tris(bromanyl)methylsulfonyl]-1,2,4-triazol-3-yl]benzaldehyde Openeye Name: 3-[4-phenyl-5-(tribromomethylsulfonyl)-1,2,4-triazol-3-yl]benzaldehyde CAS Name: 3-[4-phenyl-5-(tribromomethylsulfonyl)-1,2,4-triazol-3-yl]benzaldehyde IUPAC Name: 3-[4-phenyl-5-(tribromomethylsulfonyl)-1,2,4-triazol-3-yl]benzaldehyde Traditional Name: 3-[4-phenyl-5-(tribromomethylsulfonyl)-1,2,4-triazol-3-yl]benzaldehyde Formula: C16H10Br3N3O3S MolecularWeight: 564.0459

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2S(=O)(=O)C(Br)(Br)Br)C3=CC(=CC=C3)C=O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2S(=O)(=O)C(Br)(Br)Br)C3=CC(=CC=C3)C=O

InChI

InChI=1S/C16H10Br3N3O3S/c17-16(18,19)26(24,25)15-21-20-14(12-6-4-5-11(9-12)10-23)22(15)13-7-2-1-3-8-13/h1-10H