2-(3-chlorophenyl)-4-(2-cyclopentylethyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one

Systemtic Name: 2-(3-chlorophenyl)-4-(2-cyclopentylethyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one Openeye Name: 2-(3-chlorophenyl)-4-(2-cyclopentylethyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one CAS Name: 2-(3-chlorophenyl)-4-(2-cyclopentylethyl)-5-(4-methylsulfonylphenyl)-3-pyridazinone IUPAC Name: 2-(3-chlorophenyl)-4-(2-cyclopentylethyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one Traditional Name: 2-(3-chlorophenyl)-4-(2-cyclopentylethyl)-5-(4-mesylphenyl)pyridazin-3-one Formula: C24H25ClN2O3S MolecularWeight: 456.9849

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N(N=C2)C3=CC(=CC=C3)Cl)CCC4CCCC4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N(N=C2)C3=CC(=CC=C3)Cl)CCC4CCCC4

InChI

InChI=1S/C24H25ClN2O3S/c1-31(29,30)21-12-10-18(11-13-21)23-16-26-27(20-8-4-7-19(25)15-20)24(28)22(23)14-9-17-5-2-3-6-17/h4,7-8,10-13,15-17H,2-3,5-6,9,14H2,1H3