(2S)-N-[(4-fluoranyl-3-methyl-phenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-4-methyl-pentanamide

Systemtic Name: (2S)-N-[(4-fluoranyl-3-methyl-phenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-4-methyl-pentanamide Openeye Name: (2S)-N-[(4-fluoro-3-methyl-phenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-4-methyl-pentanamide CAS Name: (2S)-N-[(4-fluoro-3-methylphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-4-methylpentanamide IUPAC Name: (2S)-N-[(4-fluoro-3-methylphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-4-methylpentanamide Traditional Name: (2S)-N-(4-fluoro-3-methyl-benzyl)-2-[(4-methoxyphenyl)sulfonylamino]-4-methyl-valeramide Formula: C21H27FN2O4S MolecularWeight: 422.513483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)C(CC(C)C)NS(=O)(=O)C2=CC=C(C=C2)OC)F

Isomeric SMILES

CC1=C(C=CC(=C1)CNC(=O)[C@H](CC(C)C)NS(=O)(=O)C2=CC=C(C=C2)OC)F

InChI

InChI=1S/C21H27FN2O4S/c1-14(2)11-20(21(25)23-13-16-5-10-19(22)15(3)12-16)24-29(26,27)18-8-6-17(28-4)7-9-18/h5-10,12,14,20,24H,11,13H2,1-4H3,(H,23,25)/t20-/m0/s1