2-[(4-chlorophenyl)methyl]-6-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)pyridazin-3-one

Systemtic Name: 2-[(4-chlorophenyl)methyl]-6-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)pyridazin-3-one Openeye Name: 2-[(4-chlorophenyl)methyl]-6-(4-methyl-3-morpholinosulfonyl-phenyl)pyridazin-3-one CAS Name: 2-[(4-chlorophenyl)methyl]-6-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-3-pyridazinone IUPAC Name: 2-[(4-chlorophenyl)methyl]-6-(4-methyl-3-morpholin-4-ylsulfonylphenyl)pyridazin-3-one Traditional Name: 2-(4-chlorobenzyl)-6-(4-methyl-3-morpholinosulfonyl-phenyl)pyridazin-3-one Formula: C22H22ClN3O4S MolecularWeight: 459.94578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CC3=CC=C(C=C3)Cl)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CC3=CC=C(C=C3)Cl)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H22ClN3O4S/c1-16-2-5-18(14-21(16)31(28,29)25-10-12-30-13-11-25)20-8-9-22(27)26(24-20)15-17-3-6-19(23)7-4-17/h2-9,14H,10-13,15H2,1H3