1-butyl-3-[3-(trifluoromethyl)phenyl]sulfonyl-urea

Systemtic Name: 1-butyl-3-[3-(trifluoromethyl)phenyl]sulfonyl-urea Openeye Name: 1-butyl-3-[3-(trifluoromethyl)phenyl]sulfonyl-urea CAS Name: 1-butyl-3-[3-(trifluoromethyl)phenyl]sulfonylurea IUPAC Name: 1-butyl-3-[3-(trifluoromethyl)phenyl]sulfonylurea Traditional Name: 1-butyl-3-[3-(trifluoromethyl)phenyl]sulfonyl-urea Formula: C12H15F3N2O3S MolecularWeight: 324.31931

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NS(=O)(=O)C1=CC=CC(=C1)C(F)(F)F

Isomeric SMILES

CCCCNC(=O)NS(=O)(=O)C1=CC=CC(=C1)C(F)(F)F

InChI

InChI=1S/C12H15F3N2O3S/c1-2-3-7-16-11(18)17-21(19,20)10-6-4-5-9(8-10)12(13,14)15/h4-6,8H,2-3,7H2,1H3,(H2,16,17,18)