6-[(5-chloranyl-2-cyclopentyloxy-phenyl)methyl-ethyl-amino]-N-(trifluoromethylsulfonyl)pyridazine-3-carboxamide

Systemtic Name: 6-[(5-chloranyl-2-cyclopentyloxy-phenyl)methyl-ethyl-amino]-N-(trifluoromethylsulfonyl)pyridazine-3-carboxamide Openeye Name: 6-[[5-chloro-2-(cyclopentoxy)phenyl]methyl-ethyl-amino]-N-(trifluoromethylsulfonyl)pyridazine-3-carboxamide CAS Name: 6-[(5-chloro-2-cyclopentyloxyphenyl)methyl-ethylamino]-N-(trifluoromethylsulfonyl)-3-pyridazinecarboxamide IUPAC Name: 6-[(5-chloro-2-cyclopentyloxyphenyl)methyl-ethylamino]-N-(trifluoromethylsulfonyl)pyridazine-3-carboxamide Traditional Name: 6-[[5-chloro-2-(cyclopentoxy)benzyl]-ethyl-amino]-N-triflyl-pyridazine-3-carboxamide Formula: C20H22ClF3N4O4S MolecularWeight: 506.92629

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=CC(=C1)Cl)OC2CCCC2)C3=NN=C(C=C3)C(=O)NS(=O)(=O)C(F)(F)F

Isomeric SMILES

CCN(CC1=C(C=CC(=C1)Cl)OC2CCCC2)C3=NN=C(C=C3)C(=O)NS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C20H22ClF3N4O4S/c1-2-28(12-13-11-14(21)7-9-17(13)32-15-5-3-4-6-15)18-10-8-16(25-26-18)19(29)27-33(30,31)20(22,23)24/h7-11,15H,2-6,12H2,1H3,(H,27,29)