3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-N-[4-(phenylmethyl)-4-pyrrolidin-1-yl-cyclohexyl]-1,2-oxazole-4-carboxamide

Systemtic Name: 3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-N-[4-(phenylmethyl)-4-pyrrolidin-1-yl-cyclohexyl]-1,2-oxazole-4-carboxamide Openeye Name: N-(4-benzyl-4-pyrrolidin-1-yl-cyclohexyl)-3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carboxamide CAS Name: 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(phenylmethyl)-4-(1-pyrrolidinyl)cyclohexyl]-4-isoxazolecarboxamide IUPAC Name: N-(4-benzyl-4-pyrrolidin-1-ylcyclohexyl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide Traditional Name: N-(4-benzyl-4-pyrrolidino-cyclohexyl)-3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carboxamide Formula: C28H31ClFN3O2 MolecularWeight: 496.016043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)NC3CCC(CC3)(CC4=CC=CC=C4)N5CCCC5

Isomeric SMILES

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)NC3CCC(CC3)(CC4=CC=CC=C4)N5CCCC5

InChI

InChI=1S/C28H31ClFN3O2/c1-19-24(26(32-35-19)25-22(29)10-7-11-23(25)30)27(34)31-21-12-14-28(15-13-21,33-16-5-6-17-33)18-20-8-3-2-4-9-20/h2-4,7-11,21H,5-6,12-18H2,1H3,(H,31,34)