3-oxidanylidene-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]-4H-1,4-benzoxazine-6-sulfonamide

Systemtic Name: 3-oxidanylidene-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]-4H-1,4-benzoxazine-6-sulfonamide Openeye Name: 3-oxo-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]-4H-1,4-benzoxazine-6-sulfonamide CAS Name: 3-oxo-N-[2-(1-pyrazolyl)-5-(trifluoromethyl)phenyl]-4H-1,4-benzoxazine-6-sulfonamide IUPAC Name: 3-oxo-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]-4H-1,4-benzoxazine-6-sulfonamide Traditional Name: 3-keto-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]-4H-1,4-benzoxazine-6-sulfonamide Formula: C18H13F3N4O4S MolecularWeight: 438.38043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4C=CC=N4

Isomeric SMILES

C1C(=O)NC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4C=CC=N4

InChI

InChI=1S/C18H13F3N4O4S/c19-18(20,21)11-2-4-15(25-7-1-6-22-25)13(8-11)24-30(27,28)12-3-5-16-14(9-12)23-17(26)10-29-16/h1-9,24H,10H2,(H,23,26)