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

Systemtic Name: 1-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-3-pentan-3-yl-thiourea Openeye Name: 1-[4-(difluoromethylsulfanyl)phenyl]-3-(1-ethylpropyl)thiourea CAS Name: 1-[4-(difluoromethylthio)phenyl]-3-pentan-3-ylthiourea IUPAC Name: 1-[4-(difluoromethylsulfanyl)phenyl]-3-pentan-3-ylthiourea Traditional Name: 1-[4-(difluoromethylthio)phenyl]-3-(1-ethylpropyl)thiourea Formula: C13H18F2N2S2 MolecularWeight: 304.422226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=S)NC1=CC=C(C=C1)SC(F)F

Isomeric SMILES

CCC(CC)NC(=S)NC1=CC=C(C=C1)SC(F)F

InChI

InChI=1S/C13H18F2N2S2/c1-3-9(4-2)16-13(18)17-10-5-7-11(8-6-10)19-12(14)15/h5-9,12H,3-4H2,1-2H3,(H2,16,17,18)