4-tert-butyl-N-[(2S)-2-(4-fluoranyl-3-methyl-phenyl)sulfonyl-2-pyridin-3-yl-ethyl]benzamide

Systemtic Name: 4-tert-butyl-N-[(2S)-2-(4-fluoranyl-3-methyl-phenyl)sulfonyl-2-pyridin-3-yl-ethyl]benzamide Openeye Name: 4-tert-butyl-N-[(2S)-2-(4-fluoro-3-methyl-phenyl)sulfonyl-2-(3-pyridyl)ethyl]benzamide CAS Name: 4-tert-butyl-N-[(2S)-2-(4-fluoro-3-methylphenyl)sulfonyl-2-(3-pyridinyl)ethyl]benzamide IUPAC Name: 4-tert-butyl-N-[(2S)-2-(4-fluoro-3-methylphenyl)sulfonyl-2-pyridin-3-ylethyl]benzamide Traditional Name: 4-tert-butyl-N-[(2S)-2-(4-fluoro-3-methyl-phenyl)sulfonyl-2-(3-pyridyl)ethyl]benzamide Formula: C25H27FN2O3S MolecularWeight: 454.556883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)C(CNC(=O)C2=CC=C(C=C2)C(C)(C)C)C3=CN=CC=C3)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)[C@H](CNC(=O)C2=CC=C(C=C2)C(C)(C)C)C3=CN=CC=C3)F

InChI

InChI=1S/C25H27FN2O3S/c1-17-14-21(11-12-22(17)26)32(30,31)23(19-6-5-13-27-15-19)16-28-24(29)18-7-9-20(10-8-18)25(2,3)4/h5-15,23H,16H2,1-4H3,(H,28,29)/t23-/m1/s1