1-(2-bromophenyl)-3-[2-(2H-1,2,3,4-tetrazol-5-yl)-4-[4-(trifluoromethyl)phenyl]phenyl]urea

Systemtic Name: 1-(2-bromophenyl)-3-[2-(2H-1,2,3,4-tetrazol-5-yl)-4-[4-(trifluoromethyl)phenyl]phenyl]urea Openeye Name: 1-(2-bromophenyl)-3-[2-(2H-tetrazol-5-yl)-4-[4-(trifluoromethyl)phenyl]phenyl]urea CAS Name: 1-(2-bromophenyl)-3-[2-(2H-tetrazol-5-yl)-4-[4-(trifluoromethyl)phenyl]phenyl]urea IUPAC Name: 1-(2-bromophenyl)-3-[2-(2H-tetrazol-5-yl)-4-[4-(trifluoromethyl)phenyl]phenyl]urea Traditional Name: 1-(2-bromophenyl)-3-[2-(2H-tetrazol-5-yl)-4-[4-(trifluoromethyl)phenyl]phenyl]urea Formula: C21H14BrF3N6O MolecularWeight: 503.27467

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)NC2=C(C=C(C=C2)C3=CC=C(C=C3)C(F)(F)F)C4=NNN=N4)Br

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)NC2=C(C=C(C=C2)C3=CC=C(C=C3)C(F)(F)F)C4=NNN=N4)Br

InChI

InChI=1S/C21H14BrF3N6O/c22-16-3-1-2-4-18(16)27-20(32)26-17-10-7-13(11-15(17)19-28-30-31-29-19)12-5-8-14(9-6-12)21(23,24)25/h1-11H,(H2,26,27,32)(H,28,29,30,31)