(3S)-5-oxidanylidene-1-(phenylmethyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]pyrrolidine-3-carboxamide

Systemtic Name: (3S)-5-oxidanylidene-1-(phenylmethyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]pyrrolidine-3-carboxamide Openeye Name: (3S)-1-benzyl-5-oxo-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]pyrrolidine-3-carboxamide CAS Name: (3S)-5-oxo-1-(phenylmethyl)-N-[4-(2-pyrimidinylsulfamoyl)phenyl]-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-benzyl-5-oxo-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]pyrrolidine-3-carboxamide Traditional Name: (3S)-1-benzyl-5-keto-N-[4-(2-pyrimidylsulfamoyl)phenyl]pyrrolidine-3-carboxamide Formula: C22H21N5O4S MolecularWeight: 451.49824

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)CC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

Isomeric SMILES

C1[C@@H](CN(C1=O)CC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

InChI

InChI=1S/C22H21N5O4S/c28-20-13-17(15-27(20)14-16-5-2-1-3-6-16)21(29)25-18-7-9-19(10-8-18)32(30,31)26-22-23-11-4-12-24-22/h1-12,17H,13-15H2,(H,25,29)(H,23,24,26)/t17-/m0/s1