4-chloranyl-3-[(pyrimidin-2-ylamino)carbamoyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-3-[(pyrimidin-2-ylamino)carbamoyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide Openeye Name: 4-chloro-3-[(pyrimidin-2-ylamino)carbamoyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide CAS Name: 4-chloro-3-[oxo-(2-pyrimidinylhydrazo)methyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide IUPAC Name: 4-chloro-3-[(pyrimidin-2-ylamino)carbamoyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide Traditional Name: 4-chloro-3-[(2-pyrimidylamino)carbamoyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide Formula: C18H13ClF3N5O3S MolecularWeight: 471.84073

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NNC3=NC=CC=N3)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NNC3=NC=CC=N3)C(F)(F)F

InChI

InChI=1S/C18H13ClF3N5O3S/c19-15-6-5-13(10-14(15)16(28)25-26-17-23-7-2-8-24-17)31(29,30)27-12-4-1-3-11(9-12)18(20,21)22/h1-10,27H,(H,25,28)(H,23,24,26)