1-[3,5-bis(trifluoromethyl)phenyl]-3-[4-[2-chloranyl-1,1,2-tris(fluoranyl)ethoxy]phenyl]thiourea

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[4-[2-chloranyl-1,1,2-tris(fluoranyl)ethoxy]phenyl]thiourea Openeye Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[4-(2-chloro-1,1,2-trifluoro-ethoxy)phenyl]thiourea CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[4-(2-chloro-1,1,2-trifluoroethoxy)phenyl]thiourea IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[4-(2-chloro-1,1,2-trifluoroethoxy)phenyl]thiourea Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[4-(2-chloro-1,1,2-trifluoro-ethoxy)phenyl]thiourea Formula: C17H10ClF9N2OS MolecularWeight: 496.777729

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)OC(C(F)Cl)(F)F

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)OC(C(F)Cl)(F)F

InChI

InChI=1S/C17H10ClF9N2OS/c18-13(19)17(26,27)30-12-3-1-10(2-4-12)28-14(31)29-11-6-8(15(20,21)22)5-9(7-11)16(23,24)25/h1-7,13H,(H2,28,29,31)