5-(methylamino)-4-sulfanylidene-2-[3-(trifluoromethyl)phenyl]-1H-pyridazin-3-one

Systemtic Name: 5-(methylamino)-4-sulfanylidene-2-[3-(trifluoromethyl)phenyl]-1H-pyridazin-3-one Openeye Name: 5-(methylamino)-4-thioxo-2-[3-(trifluoromethyl)phenyl]-1H-pyridazin-3-one CAS Name: 5-(methylamino)-4-sulfanylidene-2-[3-(trifluoromethyl)phenyl]-1H-pyridazin-3-one IUPAC Name: 5-(methylamino)-4-sulfanylidene-2-[3-(trifluoromethyl)phenyl]-1H-pyridazin-3-one Traditional Name: 5-(methylamino)-4-thioxo-2-[3-(trifluoromethyl)phenyl]-1H-pyridazin-3-one Formula: C12H10F3N3OS MolecularWeight: 301.28751

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=CNN(C(=O)C1=S)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CNC1=CNN(C(=O)C1=S)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C12H10F3N3OS/c1-16-9-6-17-18(11(19)10(9)20)8-4-2-3-7(5-8)12(13,14)15/h2-6,16-17H,1H3