(3-chlorophenyl) N-[[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]carbamoyl]sulfamate

Systemtic Name: (3-chlorophenyl) N-[[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]carbamoyl]sulfamate Openeye Name: (3-chlorophenyl) N-[[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]carbamoyl]sulfamate CAS Name: N-[oxo-[[4-phenyl-6-(trifluoromethyl)-2-pyrimidinyl]amino]methyl]sulfamic acid (3-chlorophenyl) ester IUPAC Name: (3-chlorophenyl) N-[[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]carbamoyl]sulfamate Traditional Name: N-[[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]carbamoyl]sulfamic acid (3-chlorophenyl) ester Formula: C18H12ClF3N4O4S MolecularWeight: 472.82549

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NC(=N2)NC(=O)NS(=O)(=O)OC3=CC(=CC=C3)Cl)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NC(=N2)NC(=O)NS(=O)(=O)OC3=CC(=CC=C3)Cl)C(F)(F)F

InChI

InChI=1S/C18H12ClF3N4O4S/c19-12-7-4-8-13(9-12)30-31(28,29)26-17(27)25-16-23-14(11-5-2-1-3-6-11)10-15(24-16)18(20,21)22/h1-10H,(H2,23,24,25,26,27)