N-[3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazol-4-yl]-3-[(phenylmethyl)sulfonylmethyl]cyclohexane-1-carboxamide

Systemtic Name: N-[3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazol-4-yl]-3-[(phenylmethyl)sulfonylmethyl]cyclohexane-1-carboxamide Openeye Name: 3-(benzylsulfonylmethyl)-N-[3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazol-4-yl]cyclohexanecarboxamide CAS Name: N-[3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]-3-[(phenylmethyl)sulfonylmethyl]-1-cyclohexanecarboxamide IUPAC Name: 3-(benzylsulfonylmethyl)-N-[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]cyclohexane-1-carboxamide Traditional Name: 3-(benzylsulfonylmethyl)-N-[3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazol-4-yl]cyclohexanecarboxamide Formula: C25H26ClFN2O4S MolecularWeight: 505.001343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)NC(=O)C3CCCC(C3)CS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)NC(=O)C3CCCC(C3)CS(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C25H26ClFN2O4S/c1-16-23(24(29-33-16)22-20(26)11-6-12-21(22)27)28-25(30)19-10-5-9-18(13-19)15-34(31,32)14-17-7-3-2-4-8-17/h2-4,6-8,11-12,18-19H,5,9-10,13-15H2,1H3,(H,28,30)