1-[1-diethoxyphosphinothioylsulfanyl-2,2,2-tris(fluoranyl)ethyl]-1-methyl-3-(4-phenoxyphenyl)urea

Systemtic Name: 1-[1-diethoxyphosphinothioylsulfanyl-2,2,2-tris(fluoranyl)ethyl]-1-methyl-3-(4-phenoxyphenyl)urea Openeye Name: 1-(1-diethoxyphosphinothioylsulfanyl-2,2,2-trifluoro-ethyl)-1-methyl-3-(4-phenoxyphenyl)urea CAS Name: 1-[1-(diethoxyphosphinothioylthio)-2,2,2-trifluoroethyl]-1-methyl-3-(4-phenoxyphenyl)urea IUPAC Name: 1-(1-diethoxyphosphinothioylsulfanyl-2,2,2-trifluoroethyl)-1-methyl-3-(4-phenoxyphenyl)urea Traditional Name: 1-[1-(diethoxythiophosphorylthio)-2,2,2-trifluoro-ethyl]-1-methyl-3-(4-phenoxyphenyl)urea Formula: C20H24F3N2O4PS2 MolecularWeight: 508.514531

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=S)(OCC)SC(C(F)(F)F)N(C)C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2

Isomeric SMILES

CCOP(=S)(OCC)SC(C(F)(F)F)N(C)C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2

InChI

InChI=1S/C20H24F3N2O4PS2/c1-4-27-30(31,28-5-2)32-18(20(21,22)23)25(3)19(26)24-15-11-13-17(14-12-15)29-16-9-7-6-8-10-16/h6-14,18H,4-5H2,1-3H3,(H,24,26)