1-(azepan-1-ylsulfonyl)-3-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]urea

Systemtic Name: 1-(azepan-1-ylsulfonyl)-3-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]urea Openeye Name: 1-(azepan-1-ylsulfonyl)-3-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]urea CAS Name: 1-(1-azepanylsulfonyl)-3-[4-tert-butyl-6-(trifluoromethyl)-2-pyrimidinyl]urea IUPAC Name: 1-(azepan-1-ylsulfonyl)-3-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]urea Traditional Name: 1-(azepan-1-ylsulfonyl)-3-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]urea Formula: C16H24F3N5O3S MolecularWeight: 423.45367

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NC(=N1)NC(=O)NS(=O)(=O)N2CCCCCC2)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC(=NC(=N1)NC(=O)NS(=O)(=O)N2CCCCCC2)C(F)(F)F

InChI

InChI=1S/C16H24F3N5O3S/c1-15(2,3)11-10-12(16(17,18)19)21-13(20-11)22-14(25)23-28(26,27)24-8-6-4-5-7-9-24/h10H,4-9H2,1-3H3,(H2,20,21,22,23,25)