1-(2-tert-butylsulfanylethyl)-3-[2,3,4-tris(fluoranyl)phenyl]urea

Systemtic Name: 1-(2-tert-butylsulfanylethyl)-3-[2,3,4-tris(fluoranyl)phenyl]urea Openeye Name: 1-(2-tert-butylsulfanylethyl)-3-(2,3,4-trifluorophenyl)urea CAS Name: 1-[2-(tert-butylthio)ethyl]-3-(2,3,4-trifluorophenyl)urea IUPAC Name: 1-(2-tert-butylsulfanylethyl)-3-(2,3,4-trifluorophenyl)urea Traditional Name: 1-[2-(tert-butylthio)ethyl]-3-(2,3,4-trifluorophenyl)urea Formula: C13H17F3N2OS MolecularWeight: 306.34709

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCCNC(=O)NC1=C(C(=C(C=C1)F)F)F

Isomeric SMILES

CC(C)(C)SCCNC(=O)NC1=C(C(=C(C=C1)F)F)F

InChI

InChI=1S/C13H17F3N2OS/c1-13(2,3)20-7-6-17-12(19)18-9-5-4-8(14)10(15)11(9)16/h4-5H,6-7H2,1-3H3,(H2,17,18,19)