1-[4-[1,1,2,2,3,3,3-heptakis(fluoranyl)propylsulfanyl]phenyl]-3-(4-phenoxyphenyl)thiourea

Systemtic Name: 1-[4-[1,1,2,2,3,3,3-heptakis(fluoranyl)propylsulfanyl]phenyl]-3-(4-phenoxyphenyl)thiourea Openeye Name: 1-[4-(1,1,2,2,3,3,3-heptafluoropropylsulfanyl)phenyl]-3-(4-phenoxyphenyl)thiourea CAS Name: 1-[4-(1,1,2,2,3,3,3-heptafluoropropylthio)phenyl]-3-(4-phenoxyphenyl)thiourea IUPAC Name: 1-[4-(1,1,2,2,3,3,3-heptafluoropropylsulfanyl)phenyl]-3-(4-phenoxyphenyl)thiourea Traditional Name: 1-[4-(1,1,2,2,3,3,3-heptafluoropropylthio)phenyl]-3-(4-phenoxyphenyl)thiourea Formula: C22H15F7N2OS2 MolecularWeight: 520.486122

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)SC(C(C(F)(F)F)(F)F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)SC(C(C(F)(F)F)(F)F)(F)F

InChI

InChI=1S/C22H15F7N2OS2/c23-20(24,21(25,26)27)22(28,29)34-18-12-8-15(9-13-18)31-19(33)30-14-6-10-17(11-7-14)32-16-4-2-1-3-5-16/h1-13H,(H2,30,31,33)