6-methoxy-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)quinoline-2-carboxamide

Systemtic Name: 6-methoxy-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)quinoline-2-carboxamide Openeye Name: 6-methoxy-N-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)quinoline-2-carboxamide CAS Name: 6-methoxy-N-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]-2-quinolinecarboxamide IUPAC Name: 6-methoxy-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)quinoline-2-carboxamide Traditional Name: 6-methoxy-N-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)quinaldamide Formula: C25H28N4O5S MolecularWeight: 496.57862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(C=C2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N5CCCC5

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(C=C2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N5CCCC5

InChI

InChI=1S/C25H28N4O5S/c1-33-19-5-8-21-18(16-19)4-7-22(26-21)25(30)27-23-17-20(6-9-24(23)28-10-2-3-11-28)35(31,32)29-12-14-34-15-13-29/h4-9,16-17H,2-3,10-15H2,1H3,(H,27,30)