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

Systemtic Name: 3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-N-(4-pyrrolidin-1-ylphenyl)-1,2-oxazole-4-carboxamide Openeye Name: 3-(2-chloro-6-fluoro-phenyl)-5-methyl-N-(4-pyrrolidin-1-ylphenyl)isoxazole-4-carboxamide CAS Name: 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(1-pyrrolidinyl)phenyl]-4-isoxazolecarboxamide IUPAC Name: 3-(2-chloro-6-fluorophenyl)-5-methyl-N-(4-pyrrolidin-1-ylphenyl)-1,2-oxazole-4-carboxamide Traditional Name: 3-(2-chloro-6-fluoro-phenyl)-5-methyl-N-(4-pyrrolidinophenyl)isoxazole-4-carboxamide Formula: C21H19ClFN3O2 MolecularWeight: 399.845863

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19ClFN3O2/c1-13-18(20(25-28-13)19-16(22)5-4-6-17(19)23)21(27)24-14-7-9-15(10-8-14)26-11-2-3-12-26/h4-10H,2-3,11-12H2,1H3,(H,24,27)