1-[2-fluoranyl-5-(trifluoromethyl)phenyl]-3-(3-methylsulfanylpropyl)thiourea

Systemtic Name: 1-[2-fluoranyl-5-(trifluoromethyl)phenyl]-3-(3-methylsulfanylpropyl)thiourea Openeye Name: 1-[2-fluoro-5-(trifluoromethyl)phenyl]-3-(3-methylsulfanylpropyl)thiourea CAS Name: 1-[2-fluoro-5-(trifluoromethyl)phenyl]-3-[3-(methylthio)propyl]thiourea IUPAC Name: 1-[2-fluoro-5-(trifluoromethyl)phenyl]-3-(3-methylsulfanylpropyl)thiourea Traditional Name: 1-[2-fluoro-5-(trifluoromethyl)phenyl]-3-[3-(methylthio)propyl]thiourea Formula: C12H14F4N2S2 MolecularWeight: 326.376573

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC(=S)NC1=C(C=CC(=C1)C(F)(F)F)F

Isomeric SMILES

CSCCCNC(=S)NC1=C(C=CC(=C1)C(F)(F)F)F

InChI

InChI=1S/C12H14F4N2S2/c1-20-6-2-5-17-11(19)18-10-7-8(12(14,15)16)3-4-9(10)13/h3-4,7H,2,5-6H2,1H3,(H2,17,18,19)