N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-[ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]amino]ethanamide

Systemtic Name: N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-[ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]amino]ethanamide Openeye Name: N-(2-chloro-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-[ethyl-[(3-fluoro-4-methoxy-phenyl)methyl]amino]acetamide CAS Name: N-[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-2-[ethyl-[(3-fluoro-4-methoxyphenyl)methyl]amino]acetamide IUPAC Name: N-(2-chloro-5-pyrrolidin-1-ylsulfonylphenyl)-2-[ethyl-[(3-fluoro-4-methoxyphenyl)methyl]amino]acetamide Traditional Name: N-(2-chloro-5-pyrrolidinosulfonyl-phenyl)-2-[ethyl-(3-fluoro-4-methoxy-benzyl)amino]acetamide Formula: C22H27ClFN3O4S MolecularWeight: 483.983883

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OC)F)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OC)F)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

InChI

InChI=1S/C22H27ClFN3O4S/c1-3-26(14-16-6-9-21(31-2)19(24)12-16)15-22(28)25-20-13-17(7-8-18(20)23)32(29,30)27-10-4-5-11-27/h6-9,12-13H,3-5,10-11,14-15H2,1-2H3,(H,25,28)