N-(3-morpholin-4-ylpropyl)-2-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1H-quinoline-4-carboxamide

Systemtic Name: N-(3-morpholin-4-ylpropyl)-2-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1H-quinoline-4-carboxamide Openeye Name: N-(3-morpholinopropyl)-2-oxo-6-pyrrolidin-1-ylsulfonyl-1H-quinoline-4-carboxamide CAS Name: N-[3-(4-morpholinyl)propyl]-2-oxo-6-(1-pyrrolidinylsulfonyl)-1H-quinoline-4-carboxamide IUPAC Name: N-(3-morpholin-4-ylpropyl)-2-oxo-6-pyrrolidin-1-ylsulfonyl-1H-quinoline-4-carboxamide Traditional Name: 2-keto-N-(3-morpholinopropyl)-6-pyrrolidinosulfonyl-1H-quinoline-4-carboxamide Formula: C21H28N4O5S MolecularWeight: 448.53582

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3C(=O)NCCCN4CCOCC4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3C(=O)NCCCN4CCOCC4

InChI

InChI=1S/C21H28N4O5S/c26-20-15-18(21(27)22-6-3-7-24-10-12-30-13-11-24)17-14-16(4-5-19(17)23-20)31(28,29)25-8-1-2-9-25/h4-5,14-15H,1-3,6-13H2,(H,22,27)(H,23,26)