2-(2-chloranyl-4-pyrrolidin-1-ylsulfonyl-phenoxy)-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: 2-(2-chloranyl-4-pyrrolidin-1-ylsulfonyl-phenoxy)-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: 2-(2-chloro-4-pyrrolidin-1-ylsulfonyl-phenoxy)-N-(3-pyridylmethyl)acetamide CAS Name: 2-[2-chloro-4-(1-pyrrolidinylsulfonyl)phenoxy]-N-(3-pyridinylmethyl)acetamide IUPAC Name: 2-(2-chloro-4-pyrrolidin-1-ylsulfonylphenoxy)-N-(pyridin-3-ylmethyl)acetamide Traditional Name: 2-(2-chloro-4-pyrrolidinosulfonyl-phenoxy)-N-(3-pyridylmethyl)acetamide Formula: C18H20ClN3O4S MolecularWeight: 409.8871

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)NCC3=CN=CC=C3)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)NCC3=CN=CC=C3)Cl

InChI

InChI=1S/C18H20ClN3O4S/c19-16-10-15(27(24,25)22-8-1-2-9-22)5-6-17(16)26-13-18(23)21-12-14-4-3-7-20-11-14/h3-7,10-11H,1-2,8-9,12-13H2,(H,21,23)