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

Systemtic Name: 2-(3-chlorophenyl)-4-cyclopentyl-5-(4-methylsulfonylphenyl)pyridazin-3-one Openeye Name: 2-(3-chlorophenyl)-4-cyclopentyl-5-(4-methylsulfonylphenyl)pyridazin-3-one CAS Name: 2-(3-chlorophenyl)-4-cyclopentyl-5-(4-methylsulfonylphenyl)-3-pyridazinone IUPAC Name: 2-(3-chlorophenyl)-4-cyclopentyl-5-(4-methylsulfonylphenyl)pyridazin-3-one Traditional Name: 2-(3-chlorophenyl)-4-cyclopentyl-5-(4-mesylphenyl)pyridazin-3-one Formula: C22H21ClN2O3S MolecularWeight: 428.93174

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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)C4CCCC4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N(N=C2)C3=CC(=CC=C3)Cl)C4CCCC4

InChI

InChI=1S/C22H21ClN2O3S/c1-29(27,28)19-11-9-15(10-12-19)20-14-24-25(18-8-4-7-17(23)13-18)22(26)21(20)16-5-2-3-6-16/h4,7-14,16H,2-3,5-6H2,1H3