N-(5-tert-butyl-2-methoxy-phenyl)-2-fluoranyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(5-tert-butyl-2-methoxy-phenyl)-2-fluoranyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(5-tert-butyl-2-methoxy-phenyl)-2-fluoro-5-morpholinosulfonyl-benzamide CAS Name: N-(5-tert-butyl-2-methoxyphenyl)-2-fluoro-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(5-tert-butyl-2-methoxyphenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(5-tert-butyl-2-methoxy-phenyl)-2-fluoro-5-morpholinosulfonyl-benzamide Formula: C22H27FN2O5S MolecularWeight: 450.523583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)F

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)F

InChI

InChI=1S/C22H27FN2O5S/c1-22(2,3)15-5-8-20(29-4)19(13-15)24-21(26)17-14-16(6-7-18(17)23)31(27,28)25-9-11-30-12-10-25/h5-8,13-14H,9-12H2,1-4H3,(H,24,26)