N-[3-(1,3-benzoxazol-2-yl)phenyl]-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[3-(1,3-benzoxazol-2-yl)phenyl]-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[3-(1,3-benzoxazol-2-yl)phenyl]-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-[3-(1,3-benzoxazol-2-yl)phenyl]-1-(4-fluorophenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-[3-(1,3-benzoxazol-2-yl)phenyl]-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[3-(1,3-benzoxazol-2-yl)phenyl]-1-(4-fluorophenyl)sulfonyl-nipecotamide Formula: C25H22FN3O4S MolecularWeight: 479.523283

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NC3=CC=CC(=C3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NC3=CC=CC(=C3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C25H22FN3O4S/c26-19-10-12-21(13-11-19)34(31,32)29-14-4-6-18(16-29)24(30)27-20-7-3-5-17(15-20)25-28-22-8-1-2-9-23(22)33-25/h1-3,5,7-13,15,18H,4,6,14,16H2,(H,27,30)