N-(3-chloranyl-4-methylsulfonyl-phenyl)-3-cyclopentyl-N-[5-(dimethylamino)pyridin-2-yl]propanamide

Systemtic Name: N-(3-chloranyl-4-methylsulfonyl-phenyl)-3-cyclopentyl-N-[5-(dimethylamino)pyridin-2-yl]propanamide Openeye Name: N-(3-chloro-4-methylsulfonyl-phenyl)-3-cyclopentyl-N-[5-(dimethylamino)-2-pyridyl]propanamide CAS Name: N-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentyl-N-[5-(dimethylamino)-2-pyridinyl]propanamide IUPAC Name: N-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentyl-N-[5-(dimethylamino)pyridin-2-yl]propanamide Traditional Name: N-(3-chloro-4-mesyl-phenyl)-3-cyclopentyl-N-[5-(dimethylamino)-2-pyridyl]propionamide Formula: C22H28ClN3O3S MolecularWeight: 449.99402

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CN=C(C=C1)N(C2=CC(=C(C=C2)S(=O)(=O)C)Cl)C(=O)CCC3CCCC3

Isomeric SMILES

CN(C)C1=CN=C(C=C1)N(C2=CC(=C(C=C2)S(=O)(=O)C)Cl)C(=O)CCC3CCCC3

InChI

InChI=1S/C22H28ClN3O3S/c1-25(2)18-10-12-21(24-15-18)26(22(27)13-8-16-6-4-5-7-16)17-9-11-20(19(23)14-17)30(3,28)29/h9-12,14-16H,4-8,13H2,1-3H3