2-[(3-chlorophenyl)methyl]-7-cyclohexyl-3-(2-hydroxyethyloxy)-5-methyl-thieno[2,3-d]pyridazin-4-one

Systemtic Name: 2-[(3-chlorophenyl)methyl]-7-cyclohexyl-3-(2-hydroxyethyloxy)-5-methyl-thieno[2,3-d]pyridazin-4-one Openeye Name: 2-[(3-chlorophenyl)methyl]-7-cyclohexyl-3-(2-hydroxyethoxy)-5-methyl-thieno[2,3-d]pyridazin-4-one CAS Name: 2-[(3-chlorophenyl)methyl]-7-cyclohexyl-3-(2-hydroxyethoxy)-5-methyl-4-thieno[2,3-d]pyridazinone IUPAC Name: 2-[(3-chlorophenyl)methyl]-7-cyclohexyl-3-(2-hydroxyethoxy)-5-methylthieno[2,3-d]pyridazin-4-one Traditional Name: 2-(3-chlorobenzyl)-7-cyclohexyl-3-(2-hydroxyethoxy)-5-methyl-thieno[2,3-d]pyridazin-4-one Formula: C22H25ClN2O3S MolecularWeight: 432.9635

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C(=N1)C3CCCCC3)SC(=C2OCCO)CC4=CC(=CC=C4)Cl

Isomeric SMILES

CN1C(=O)C2=C(C(=N1)C3CCCCC3)SC(=C2OCCO)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H25ClN2O3S/c1-25-22(27)18-20(28-11-10-26)17(13-14-6-5-9-16(23)12-14)29-21(18)19(24-25)15-7-3-2-4-8-15/h5-6,9,12,15,26H,2-4,7-8,10-11,13H2,1H3