(2R)-2-azanyl-N-[(2S)-1-[(4-fluorophenyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-methyl-pentanamide

Systemtic Name: (2R)-2-azanyl-N-[(2S)-1-[(4-fluorophenyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-methyl-pentanamide Openeye Name: (2R)-2-amino-N-[(1S)-1-benzyl-2-(4-fluoroanilino)-2-oxo-ethyl]-4-methyl-pentanamide CAS Name: (2R)-2-amino-N-[(2S)-1-(4-fluoroanilino)-1-oxo-3-phenylpropan-2-yl]-4-methylpentanamide IUPAC Name: (2R)-2-amino-N-[(2S)-1-(4-fluoroanilino)-1-oxo-3-phenylpropan-2-yl]-4-methylpentanamide Traditional Name: (2R)-2-amino-N-[(1S)-1-benzyl-2-(4-fluoroanilino)-2-keto-ethyl]-4-methyl-valeramide Formula: C21H26FN3O2 MolecularWeight: 371.448443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)F)N

Isomeric SMILES

CC(C)C[C@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)F)N

InChI

InChI=1S/C21H26FN3O2/c1-14(2)12-18(23)20(26)25-19(13-15-6-4-3-5-7-15)21(27)24-17-10-8-16(22)9-11-17/h3-11,14,18-19H,12-13,23H2,1-2H3,(H,24,27)(H,25,26)/t18-,19+/m1/s1