(2S)-1-(4-fluorophenyl)sulfonyl-N-(3-phenylmethoxypropyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-(4-fluorophenyl)sulfonyl-N-(3-phenylmethoxypropyl)pyrrolidine-2-carboxamide Openeye Name: (2S)-N-(3-benzyloxypropyl)-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: (2S)-1-(4-fluorophenyl)sulfonyl-N-(3-phenylmethoxypropyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-(4-fluorophenyl)sulfonyl-N-(3-phenylmethoxypropyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-(3-benzoxypropyl)-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide Formula: C21H25FN2O4S MolecularWeight: 420.497603

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NCCCOCC3=CC=CC=C3

Isomeric SMILES

C1C[C@H](N(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NCCCOCC3=CC=CC=C3

InChI

InChI=1S/C21H25FN2O4S/c22-18-9-11-19(12-10-18)29(26,27)24-14-4-8-20(24)21(25)23-13-5-15-28-16-17-6-2-1-3-7-17/h1-3,6-7,9-12,20H,4-5,8,13-16H2,(H,23,25)/t20-/m0/s1