(3S)-N-(4-fluoranyl-3-morpholin-4-ylsulfonyl-phenyl)-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-(4-fluoranyl-3-morpholin-4-ylsulfonyl-phenyl)-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-(4-fluoro-3-morpholinosulfonyl-phenyl)-5-oxo-1-phenethyl-pyrrolidine-3-carboxamide CAS Name: (3S)-N-[4-fluoro-3-(4-morpholinylsulfonyl)phenyl]-5-oxo-1-phenethyl-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)-5-oxo-1-phenethylpyrrolidine-3-carboxamide Traditional Name: (3S)-N-(4-fluoro-3-morpholinosulfonyl-phenyl)-5-keto-1-phenethyl-pyrrolidine-3-carboxamide Formula: C23H26FN3O5S MolecularWeight: 475.533043

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C3CC(=O)N(C3)CCC4=CC=CC=C4)F

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)NC(=O)[C@H]3CC(=O)N(C3)CCC4=CC=CC=C4)F

InChI

InChI=1S/C23H26FN3O5S/c24-20-7-6-19(15-21(20)33(30,31)27-10-12-32-13-11-27)25-23(29)18-14-22(28)26(16-18)9-8-17-4-2-1-3-5-17/h1-7,15,18H,8-14,16H2,(H,25,29)/t18-/m0/s1