N-(4-bromanyl-2-fluoranyl-phenyl)-1-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-1-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-1-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-1-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-1-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-1-[(2-keto-3-methyl-1,3-benzoxazol-6-yl)sulfonyl]nipecotamide Formula: C20H19BrFN3O5S MolecularWeight: 512.349363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)NC4=C(C=C(C=C4)Br)F)OC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)NC4=C(C=C(C=C4)Br)F)OC1=O

InChI

InChI=1S/C20H19BrFN3O5S/c1-24-17-7-5-14(10-18(17)30-20(24)27)31(28,29)25-8-2-3-12(11-25)19(26)23-16-6-4-13(21)9-15(16)22/h4-7,9-10,12H,2-3,8,11H2,1H3,(H,23,26)