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

Systemtic Name: 1-cycloheptyl-3-[4-[[3-(trifluoromethyl)phenyl]amino]pyridin-3-yl]sulfonyl-urea Openeye Name: 1-cycloheptyl-3-[[4-[3-(trifluoromethyl)anilino]-3-pyridyl]sulfonyl]urea CAS Name: 1-cycloheptyl-3-[[4-[3-(trifluoromethyl)anilino]-3-pyridinyl]sulfonyl]urea IUPAC Name: 1-cycloheptyl-3-[4-[3-(trifluoromethyl)anilino]pyridin-3-yl]sulfonylurea Traditional Name: 1-cycloheptyl-3-[[4-[3-(trifluoromethyl)anilino]-3-pyridyl]sulfonyl]urea Formula: C20H23F3N4O3S MolecularWeight: 456.48183

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)NS(=O)(=O)C2=C(C=CN=C2)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CCCC(CC1)NC(=O)NS(=O)(=O)C2=C(C=CN=C2)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C20H23F3N4O3S/c21-20(22,23)14-6-5-9-16(12-14)25-17-10-11-24-13-18(17)31(29,30)27-19(28)26-15-7-3-1-2-4-8-15/h5-6,9-13,15H,1-4,7-8H2,(H,24,25)(H2,26,27,28)