4-(3-chloranyl-2-cyano-phenoxy)-N-ethyl-N-(pyridin-4-ylmethyl)benzenesulfonamide

Systemtic Name: 4-(3-chloranyl-2-cyano-phenoxy)-N-ethyl-N-(pyridin-4-ylmethyl)benzenesulfonamide Openeye Name: 4-(3-chloro-2-cyano-phenoxy)-N-ethyl-N-(4-pyridylmethyl)benzenesulfonamide CAS Name: 4-(3-chloro-2-cyanophenoxy)-N-ethyl-N-(pyridin-4-ylmethyl)benzenesulfonamide IUPAC Name: 4-(3-chloro-2-cyanophenoxy)-N-ethyl-N-(pyridin-4-ylmethyl)benzenesulfonamide Traditional Name: 4-(3-chloro-2-cyano-phenoxy)-N-ethyl-N-(4-pyridylmethyl)benzenesulfonamide Formula: C21H18ClN3O3S MolecularWeight: 427.90392

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=NC=C1)S(=O)(=O)C2=CC=C(C=C2)OC3=C(C(=CC=C3)Cl)C#N

Isomeric SMILES

CCN(CC1=CC=NC=C1)S(=O)(=O)C2=CC=C(C=C2)OC3=C(C(=CC=C3)Cl)C#N

InChI

InChI=1S/C21H18ClN3O3S/c1-2-25(15-16-10-12-24-13-11-16)29(26,27)18-8-6-17(7-9-18)28-21-5-3-4-20(22)19(21)14-23/h3-13H,2,15H2,1H3