1-cyclooctyl-3-[4-[[3-(trifluoromethyl)phenyl]amino]pyridin-3-yl]sulfonyl-urea

Systemtic Name: 1-cyclooctyl-3-[4-[[3-(trifluoromethyl)phenyl]amino]pyridin-3-yl]sulfonyl-urea Openeye Name: 1-cyclooctyl-3-[[4-[3-(trifluoromethyl)anilino]-3-pyridyl]sulfonyl]urea CAS Name: 1-cyclooctyl-3-[[4-[3-(trifluoromethyl)anilino]-3-pyridinyl]sulfonyl]urea IUPAC Name: 1-cyclooctyl-3-[4-[3-(trifluoromethyl)anilino]pyridin-3-yl]sulfonylurea Traditional Name: 1-cyclooctyl-3-[[4-[3-(trifluoromethyl)anilino]-3-pyridyl]sulfonyl]urea Formula: C21H25F3N4O3S MolecularWeight: 470.50841

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)NS(=O)(=O)C2=C(C=CN=C2)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CCCC(CCC1)NC(=O)NS(=O)(=O)C2=C(C=CN=C2)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C21H25F3N4O3S/c22-21(23,24)15-7-6-10-17(13-15)26-18-11-12-25-14-19(18)32(30,31)28-20(29)27-16-8-4-2-1-3-5-9-16/h6-7,10-14,16H,1-5,8-9H2,(H,25,26)(H2,27,28,29)