(2S)-1-(2-fluorophenyl)sulfonyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-(2-fluorophenyl)sulfonyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)pyrrolidine-2-carboxamide Openeye Name: (2S)-1-(2-fluorophenyl)sulfonyl-N-(2-morpholino-1,3-benzothiazol-6-yl)pyrrolidine-2-carboxamide CAS Name: (2S)-1-(2-fluorophenyl)sulfonyl-N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-(2-fluorophenyl)sulfonyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)pyrrolidine-2-carboxamide Traditional Name: (2S)-1-(2-fluorophenyl)sulfonyl-N-(2-morpholino-1,3-benzothiazol-6-yl)pyrrolidine-2-carboxamide Formula: C22H23FN4O4S2 MolecularWeight: 490.570823

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=CC=C2F)C(=O)NC3=CC4=C(C=C3)N=C(S4)N5CCOCC5

Isomeric SMILES

C1C[C@H](N(C1)S(=O)(=O)C2=CC=CC=C2F)C(=O)NC3=CC4=C(C=C3)N=C(S4)N5CCOCC5

InChI

InChI=1S/C22H23FN4O4S2/c23-16-4-1-2-6-20(16)33(29,30)27-9-3-5-18(27)21(28)24-15-7-8-17-19(14-15)32-22(25-17)26-10-12-31-13-11-26/h1-2,4,6-8,14,18H,3,5,9-13H2,(H,24,28)/t18-/m0/s1