N-[[(5S)-3-[4-[4-[4-[(E)-2-cyanoethenyl]-1,2,3-triazol-1-yl]piperidin-1-yl]-3-fluoranyl-phenyl]-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]ethanamide

Systemtic Name: N-[[(5S)-3-[4-[4-[4-[(E)-2-cyanoethenyl]-1,2,3-triazol-1-yl]piperidin-1-yl]-3-fluoranyl-phenyl]-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]ethanamide Openeye Name: N-[[(5S)-3-[4-[4-[4-[(E)-2-cyanovinyl]triazol-1-yl]-1-piperidyl]-3-fluoro-phenyl]-2-oxo-oxazolidin-5-yl]methyl]acetamide CAS Name: N-[[(5S)-3-[4-[4-[4-[(E)-2-cyanoethenyl]-1-triazolyl]-1-piperidinyl]-3-fluorophenyl]-2-oxo-5-oxazolidinyl]methyl]acetamide IUPAC Name: N-[[(5S)-3-[4-[4-[4-[(E)-2-cyanoethenyl]triazol-1-yl]piperidin-1-yl]-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide Traditional Name: N-[[(5S)-3-[4-[4-[4-[(E)-2-cyanovinyl]triazol-1-yl]piperidino]-3-fluoro-phenyl]-2-keto-oxazolidin-5-yl]methyl]acetamide Formula: C22H24FN7O3 MolecularWeight: 453.469463

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1CN(C(=O)O1)C2=CC(=C(C=C2)N3CCC(CC3)N4C=C(N=N4)C=CC#N)F

Isomeric SMILES

CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)N3CCC(CC3)N4C=C(N=N4)/C=C/C#N)F

InChI

InChI=1S/C22H24FN7O3/c1-15(31)25-12-19-14-29(22(32)33-19)18-4-5-21(20(23)11-18)28-9-6-17(7-10-28)30-13-16(26-27-30)3-2-8-24/h2-5,11,13,17,19H,6-7,9-10,12,14H2,1H3,(H,25,31)/b3-2+/t19-/m0/s1