3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)-1,2-oxazole-4-carboxamide

Systemtic Name: 3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)-1,2-oxazole-4-carboxamide Openeye Name: 3-(2-chloro-6-fluoro-phenyl)-5-methyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)isoxazole-4-carboxamide CAS Name: 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[3-(1-pyrrolidinylsulfonyl)phenyl]-4-isoxazolecarboxamide IUPAC Name: 3-(2-chloro-6-fluorophenyl)-5-methyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)-1,2-oxazole-4-carboxamide Traditional Name: 3-(2-chloro-6-fluoro-phenyl)-5-methyl-N-(3-pyrrolidinosulfonylphenyl)isoxazole-4-carboxamide Formula: C21H19ClFN3O4S MolecularWeight: 463.909663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H19ClFN3O4S/c1-13-18(20(25-30-13)19-16(22)8-5-9-17(19)23)21(27)24-14-6-4-7-15(12-14)31(28,29)26-10-2-3-11-26/h4-9,12H,2-3,10-11H2,1H3,(H,24,27)