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

Systemtic Name: (2R)-2-azanyl-N-[(2S)-1-[(4-fluorophenyl)methylamino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-methyl-pentanamide Openeye Name: (2R)-2-amino-N-[(1S)-1-benzyl-2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl]-4-methyl-pentanamide CAS Name: (2R)-2-amino-N-[(2S)-1-[(4-fluorophenyl)methylamino]-1-oxo-3-phenylpropan-2-yl]-4-methylpentanamide IUPAC Name: (2R)-2-amino-N-[(2S)-1-[(4-fluorophenyl)methylamino]-1-oxo-3-phenylpropan-2-yl]-4-methylpentanamide Traditional Name: (2R)-2-amino-N-[(1S)-1-benzyl-2-[(4-fluorobenzyl)amino]-2-keto-ethyl]-4-methyl-valeramide Formula: C22H28FN3O2 MolecularWeight: 385.475023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NCC2=CC=C(C=C2)F)N

Isomeric SMILES

CC(C)C[C@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCC2=CC=C(C=C2)F)N

InChI

InChI=1S/C22H28FN3O2/c1-15(2)12-19(24)21(27)26-20(13-16-6-4-3-5-7-16)22(28)25-14-17-8-10-18(23)11-9-17/h3-11,15,19-20H,12-14,24H2,1-2H3,(H,25,28)(H,26,27)/t19-,20+/m1/s1