1-[(4-methylsulfanylphenyl)methyl]-3-[2,2,4,4-tetrakis(fluoranyl)-1,3-benzodioxin-6-yl]urea

Systemtic Name: 1-[(4-methylsulfanylphenyl)methyl]-3-[2,2,4,4-tetrakis(fluoranyl)-1,3-benzodioxin-6-yl]urea Openeye Name: 1-[(4-methylsulfanylphenyl)methyl]-3-(2,2,4,4-tetrafluoro-1,3-benzodioxin-6-yl)urea CAS Name: 1-[[4-(methylthio)phenyl]methyl]-3-(2,2,4,4-tetrafluoro-1,3-benzodioxin-6-yl)urea IUPAC Name: 1-[(4-methylsulfanylphenyl)methyl]-3-(2,2,4,4-tetrafluoro-1,3-benzodioxin-6-yl)urea Traditional Name: 1-[4-(methylthio)benzyl]-3-(2,2,4,4-tetrafluoro-1,3-benzodioxin-6-yl)urea Formula: C17H14F4N2O3S MolecularWeight: 402.363273

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CNC(=O)NC2=CC3=C(C=C2)OC(OC3(F)F)(F)F

Isomeric SMILES

CSC1=CC=C(C=C1)CNC(=O)NC2=CC3=C(C=C2)OC(OC3(F)F)(F)F

InChI

InChI=1S/C17H14F4N2O3S/c1-27-12-5-2-10(3-6-12)9-22-15(24)23-11-4-7-14-13(8-11)16(18,19)26-17(20,21)25-14/h2-8H,9H2,1H3,(H2,22,23,24)