6-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-phenethyl-pyridazin-3-one

Systemtic Name: 6-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-phenethyl-pyridazin-3-one Openeye Name: 6-(4-methyl-3-morpholinosulfonyl-phenyl)-2-phenethyl-pyridazin-3-one CAS Name: 6-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-2-phenethyl-3-pyridazinone IUPAC Name: 6-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-2-phenethylpyridazin-3-one Traditional Name: 6-(4-methyl-3-morpholinosulfonyl-phenyl)-2-phenethyl-pyridazin-3-one Formula: C23H25N3O4S MolecularWeight: 439.5273

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CCC3=CC=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CCC3=CC=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C23H25N3O4S/c1-18-7-8-20(17-22(18)31(28,29)25-13-15-30-16-14-25)21-9-10-23(27)26(24-21)12-11-19-5-3-2-4-6-19/h2-10,17H,11-16H2,1H3