N-(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)-2-cyclopropyl-quinoline-4-carboxamide

Systemtic Name: N-(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)-2-cyclopropyl-quinoline-4-carboxamide Openeye Name: N-(4-chloro-3-morpholinosulfonyl-phenyl)-2-cyclopropyl-quinoline-4-carboxamide CAS Name: N-[4-chloro-3-(4-morpholinylsulfonyl)phenyl]-2-cyclopropyl-4-quinolinecarboxamide IUPAC Name: N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)-2-cyclopropylquinoline-4-carboxamide Traditional Name: N-(4-chloro-3-morpholinosulfonyl-phenyl)-2-cyclopropyl-cinchoninamide Formula: C23H22ClN3O4S MolecularWeight: 471.95648

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=C(C=C4)Cl)S(=O)(=O)N5CCOCC5

Isomeric SMILES

C1CC1C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=C(C=C4)Cl)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C23H22ClN3O4S/c24-19-8-7-16(13-22(19)32(29,30)27-9-11-31-12-10-27)25-23(28)18-14-21(15-5-6-15)26-20-4-2-1-3-17(18)20/h1-4,7-8,13-15H,5-6,9-12H2,(H,25,28)