N-[4-bromanyl-2-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[4-bromanyl-2-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[4-bromo-2-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[4-bromo-2-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[4-bromo-2-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl]-4-methylbenzenesulfonamide Traditional Name: N-[4-bromo-2-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl]-4-methyl-benzenesulfonamide Formula: C16H14BrN5O2S MolecularWeight: 420.28366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Br)C=NN3C=NN=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Br)/C=N/N3C=NN=C3

InChI

InChI=1S/C16H14BrN5O2S/c1-12-2-5-15(6-3-12)25(23,24)21-16-7-4-14(17)8-13(16)9-20-22-10-18-19-11-22/h2-11,21H,1H3/b20-9+