2-chloranyl-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)quinoline-4-carboxamide

Systemtic Name: 2-chloranyl-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)quinoline-4-carboxamide Openeye Name: 2-chloro-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)quinoline-4-carboxamide CAS Name: 2-chloro-N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-4-quinolinecarboxamide IUPAC Name: 2-chloro-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)quinoline-4-carboxamide Traditional Name: 2-chloro-N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)cinchoninamide Formula: C22H22ClN3O4S MolecularWeight: 459.94578

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)Cl)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)Cl)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H22ClN3O4S/c1-2-30-19-10-9-15(13-20(19)31(28,29)26-11-5-6-12-26)24-22(27)17-14-21(23)25-18-8-4-3-7-16(17)18/h3-4,7-10,13-14H,2,5-6,11-12H2,1H3,(H,24,27)