4-[2-chloranyl-3-(2-ethylmorpholin-4-yl)-4-methylsulfonyl-phenyl]carbonyl-2-ethyl-1H-pyrazol-3-one

Systemtic Name: 4-[2-chloranyl-3-(2-ethylmorpholin-4-yl)-4-methylsulfonyl-phenyl]carbonyl-2-ethyl-1H-pyrazol-3-one Openeye Name: 4-[2-chloro-3-(2-ethylmorpholin-4-yl)-4-methylsulfonyl-benzoyl]-2-ethyl-1H-pyrazol-3-one CAS Name: 4-[[2-chloro-3-(2-ethyl-4-morpholinyl)-4-methylsulfonylphenyl]-oxomethyl]-2-ethyl-1H-pyrazol-3-one IUPAC Name: 4-[2-chloro-3-(2-ethylmorpholin-4-yl)-4-methylsulfonylbenzoyl]-2-ethyl-1H-pyrazol-3-one Traditional Name: 4-[2-chloro-3-(2-ethylmorpholino)-4-mesyl-benzoyl]-2-ethyl-3-pyrazolin-3-one Formula: C19H24ClN3O5S MolecularWeight: 441.92896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CCO1)C2=C(C=CC(=C2Cl)C(=O)C3=CNN(C3=O)CC)S(=O)(=O)C

Isomeric SMILES

CCC1CN(CCO1)C2=C(C=CC(=C2Cl)C(=O)C3=CNN(C3=O)CC)S(=O)(=O)C

InChI

InChI=1S/C19H24ClN3O5S/c1-4-12-11-22(8-9-28-12)17-15(29(3,26)27)7-6-13(16(17)20)18(24)14-10-21-23(5-2)19(14)25/h6-7,10,12,21H,4-5,8-9,11H2,1-3H3