2-[(2S,3R)-3-azanyl-4-(2-fluorophenyl)-2-oxidanyl-butyl]-N-(2-phenylpropan-2-yl)pyridine-3-carboxamide

Systemtic Name: 2-[(2S,3R)-3-azanyl-4-(2-fluorophenyl)-2-oxidanyl-butyl]-N-(2-phenylpropan-2-yl)pyridine-3-carboxamide Openeye Name: 2-[(2S,3R)-3-amino-4-(2-fluorophenyl)-2-hydroxy-butyl]-N-(1-methyl-1-phenyl-ethyl)pyridine-3-carboxamide CAS Name: 2-[(2S,3R)-3-amino-4-(2-fluorophenyl)-2-hydroxybutyl]-N-(2-phenylpropan-2-yl)-3-pyridinecarboxamide IUPAC Name: 2-[(2S,3R)-3-amino-4-(2-fluorophenyl)-2-hydroxybutyl]-N-(2-phenylpropan-2-yl)pyridine-3-carboxamide Traditional Name: 2-[(2S,3R)-3-amino-4-(2-fluorophenyl)-2-hydroxy-butyl]-N-cumyl-nicotinamide Formula: C25H28FN3O2 MolecularWeight: 421.507123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)NC(=O)C2=C(N=CC=C2)CC(C(CC3=CC=CC=C3F)N)O

Isomeric SMILES

CC(C)(C1=CC=CC=C1)NC(=O)C2=C(N=CC=C2)C[C@@H]([C@@H](CC3=CC=CC=C3F)N)O

InChI

InChI=1S/C25H28FN3O2/c1-25(2,18-10-4-3-5-11-18)29-24(31)19-12-8-14-28-22(19)16-23(30)21(27)15-17-9-6-7-13-20(17)26/h3-14,21,23,30H,15-16,27H2,1-2H3,(H,29,31)/t21-,23+/m1/s1