N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: N-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)-1,3-benzothiazole-6-carboxamide CAS Name: N-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: N-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)-1,3-benzothiazole-6-carboxamide Formula: C22H24N4O4S2 MolecularWeight: 472.58036

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC5=C(C=C4)N=CS5

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC5=C(C=C4)N=CS5

InChI

InChI=1S/C22H24N4O4S2/c27-22(16-3-5-18-21(13-16)31-15-23-18)24-19-14-17(4-6-20(19)25-7-1-2-8-25)32(28,29)26-9-11-30-12-10-26/h3-6,13-15H,1-2,7-12H2,(H,24,27)