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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C(=O)C=CC(=N2)C3=CC(=C(C=C3)C)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=CC(=CC=C1)CN2C(=O)C=CC(=N2)C3=CC(=C(C=C3)C)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C23H25N3O4S/c1-17-4-3-5-19(14-17)16-26-23(27)9-8-21(24-26)20-7-6-18(2)22(15-20)31(28,29)25-10-12-30-13-11-25/h3-9,14-15H,10-13,16H2,1-2H3