(2R)-N-(1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2R)-N-(1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxamide Openeye Name: (2R)-N-(1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide CAS Name: (2R)-N-(1,3-benzothiazol-2-yl)-N-[3-(4-morpholinyl)propyl]-1-thiophen-2-ylsulfonyl-2-pyrrolidinecarboxamide IUPAC Name: (2R)-N-(1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-1-thiophen-2-ylsulfonylpyrrolidine-2-carboxamide Traditional Name: (2R)-N-(1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide Formula: C23H28N4O4S3 MolecularWeight: 520.68782

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=CS2)C(=O)N(CCCN3CCOCC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[C@@H](N(C1)S(=O)(=O)C2=CC=CS2)C(=O)N(CCCN3CCOCC3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H28N4O4S3/c28-22(19-7-3-12-27(19)34(29,30)21-9-4-17-32-21)26(11-5-10-25-13-15-31-16-14-25)23-24-18-6-1-2-8-20(18)33-23/h1-2,4,6,8-9,17,19H,3,5,7,10-16H2/t19-/m1/s1