(2S)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-(4-fluoranylphenoxy)propanamide

Systemtic Name: (2S)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-(4-fluoranylphenoxy)propanamide Openeye Name: (2S)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-(4-fluorophenoxy)propanamide CAS Name: (2S)-N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-2-(4-fluorophenoxy)propanamide IUPAC Name: (2S)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-2-(4-fluorophenoxy)propanamide Traditional Name: (2S)-N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-2-(4-fluorophenoxy)propionamide Formula: C21H25FN2O5S MolecularWeight: 436.497003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C(C)OC2=CC=C(C=C2)F)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)[C@H](C)OC2=CC=C(C=C2)F)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H25FN2O5S/c1-3-28-19-11-8-17(14-20(19)30(26,27)24-12-4-5-13-24)23-21(25)15(2)29-18-9-6-16(22)7-10-18/h6-11,14-15H,3-5,12-13H2,1-2H3,(H,23,25)/t15-/m0/s1