5-bromanyl-2-methyl-N-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]benzenesulfonamide

Systemtic Name: 5-bromanyl-2-methyl-N-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]benzenesulfonamide Openeye Name: 5-bromo-2-methyl-N-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]benzenesulfonamide CAS Name: 5-bromo-2-methyl-N-[4-[(4-methyl-1,2,4-triazol-3-yl)thio]phenyl]benzenesulfonamide IUPAC Name: 5-bromo-2-methyl-N-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]benzenesulfonamide Traditional Name: 5-bromo-2-methyl-N-[4-[(4-methyl-1,2,4-triazol-3-yl)thio]phenyl]benzenesulfonamide Formula: C16H15BrN4O2S2 MolecularWeight: 439.3499

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)SC3=NN=CN3C

Isomeric SMILES

CC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)SC3=NN=CN3C

InChI

InChI=1S/C16H15BrN4O2S2/c1-11-3-4-12(17)9-15(11)25(22,23)20-13-5-7-14(8-6-13)24-16-19-18-10-21(16)2/h3-10,20H,1-2H3