N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)-1-benzothiophene-2-carboxamide

Systemtic Name: N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)-1-benzothiophene-2-carboxamide Openeye Name: N-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)benzothiophene-2-carboxamide CAS Name: N-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)-1-benzothiophene-2-carboxamide Traditional Name: N-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)benzothiophene-2-carboxamide Formula: C23H25N3O4S2 MolecularWeight: 471.5923

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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=CC=CC=C5S4

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC5=CC=CC=C5S4

InChI

InChI=1S/C23H25N3O4S2/c27-23(22-15-17-5-1-2-6-21(17)31-22)24-19-16-18(7-8-20(19)25-9-3-4-10-25)32(28,29)26-11-13-30-14-12-26/h1-2,5-8,15-16H,3-4,9-14H2,(H,24,27)