1-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-3-cyclooctyl-thiourea

Systemtic Name: 1-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-3-cyclooctyl-thiourea Openeye Name: 1-cyclooctyl-3-[4-(difluoromethylsulfanyl)phenyl]thiourea CAS Name: 1-cyclooctyl-3-[4-(difluoromethylthio)phenyl]thiourea IUPAC Name: 1-cyclooctyl-3-[4-(difluoromethylsulfanyl)phenyl]thiourea Traditional Name: 1-cyclooctyl-3-[4-(difluoromethylthio)phenyl]thiourea Formula: C16H22F2N2S2 MolecularWeight: 344.486086

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=S)NC2=CC=C(C=C2)SC(F)F

Isomeric SMILES

C1CCCC(CCC1)NC(=S)NC2=CC=C(C=C2)SC(F)F

InChI

InChI=1S/C16H22F2N2S2/c17-15(18)22-14-10-8-13(9-11-14)20-16(21)19-12-6-4-2-1-3-5-7-12/h8-12,15H,1-7H2,(H2,19,20,21)