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

Systemtic Name: 1-[4-fluoranyl-3-(trifluoromethyl)phenyl]-3-[2-(2H-1,2,3,4-tetrazol-5-yl)-4-[4-(trifluoromethyl)phenyl]phenyl]urea Openeye Name: 1-[4-fluoro-3-(trifluoromethyl)phenyl]-3-[2-(2H-tetrazol-5-yl)-4-[4-(trifluoromethyl)phenyl]phenyl]urea CAS Name: 1-[4-fluoro-3-(trifluoromethyl)phenyl]-3-[2-(2H-tetrazol-5-yl)-4-[4-(trifluoromethyl)phenyl]phenyl]urea IUPAC Name: 1-[4-fluoro-3-(trifluoromethyl)phenyl]-3-[2-(2H-tetrazol-5-yl)-4-[4-(trifluoromethyl)phenyl]phenyl]urea Traditional Name: 1-[4-fluoro-3-(trifluoromethyl)phenyl]-3-[2-(2H-tetrazol-5-yl)-4-[4-(trifluoromethyl)phenyl]phenyl]urea Formula: C22H13F7N6O MolecularWeight: 510.367042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(=C(C=C2)NC(=O)NC3=CC(=C(C=C3)F)C(F)(F)F)C4=NNN=N4)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C2=CC(=C(C=C2)NC(=O)NC3=CC(=C(C=C3)F)C(F)(F)F)C4=NNN=N4)C(F)(F)F

InChI

InChI=1S/C22H13F7N6O/c23-17-7-6-14(10-16(17)22(27,28)29)30-20(36)31-18-8-3-12(9-15(18)19-32-34-35-33-19)11-1-4-13(5-2-11)21(24,25)26/h1-10H,(H2,30,31,36)(H,32,33,34,35)