1-[[4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]carbonylamino]-3-phenyl-thiourea

Systemtic Name: 1-[[4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]carbonylamino]-3-phenyl-thiourea Openeye Name: 1-[[4-[2-nitro-4-(trifluoromethyl)phenoxy]benzoyl]amino]-3-phenyl-thiourea CAS Name: 1-[[[4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]-oxomethyl]amino]-3-phenylthiourea IUPAC Name: 1-[[4-[2-nitro-4-(trifluoromethyl)phenoxy]benzoyl]amino]-3-phenylthiourea Traditional Name: 1-[[4-[2-nitro-4-(trifluoromethyl)phenoxy]benzoyl]amino]-3-phenyl-thiourea Formula: C21H15F3N4O4S MolecularWeight: 476.42841

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC=C(C=C2)OC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC=C(C=C2)OC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C21H15F3N4O4S/c22-21(23,24)14-8-11-18(17(12-14)28(30)31)32-16-9-6-13(7-10-16)19(29)26-27-20(33)25-15-4-2-1-3-5-15/h1-12H,(H,26,29)(H2,25,27,33)