(2S)-N-(6-chloranylquinolin-8-yl)-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-(6-chloranylquinolin-8-yl)-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-(6-chloro-8-quinolyl)-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: (2S)-N-(6-chloro-8-quinolinyl)-1-(4-fluorophenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-(6-chloroquinolin-8-yl)-1-(4-fluorophenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: (2S)-N-(6-chloro-8-quinolyl)-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide Formula: C20H17ClFN3O3S MolecularWeight: 433.883683

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NC3=C4C(=CC(=C3)Cl)C=CC=N4

Isomeric SMILES

C1C[C@H](N(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NC3=C4C(=CC(=C3)Cl)C=CC=N4

InChI

InChI=1S/C20H17ClFN3O3S/c21-14-11-13-3-1-9-23-19(13)17(12-14)24-20(26)18-4-2-10-25(18)29(27,28)16-7-5-15(22)6-8-16/h1,3,5-9,11-12,18H,2,4,10H2,(H,24,26)/t18-/m0/s1