(2S)-2-acetamido-N-[(2S,4S,5S)-5-azanyl-4-oxidanyl-1,6-diphenyl-hexan-2-yl]-3-methyl-butanamide

Systemtic Name: (2S)-2-acetamido-N-[(2S,4S,5S)-5-azanyl-4-oxidanyl-1,6-diphenyl-hexan-2-yl]-3-methyl-butanamide Openeye Name: (2S)-2-acetamido-N-[(1S,3S,4S)-4-amino-1-benzyl-3-hydroxy-5-phenyl-pentyl]-3-methyl-butanamide CAS Name: (2S)-2-acetamido-N-[(2S,4S,5S)-5-amino-4-hydroxy-1,6-diphenylhexan-2-yl]-3-methylbutanamide IUPAC Name: (2S)-2-acetamido-N-[(2S,4S,5S)-5-amino-4-hydroxy-1,6-diphenylhexan-2-yl]-3-methylbutanamide Traditional Name: (2S)-2-acetamido-N-[(1S,3S,4S)-4-amino-1-benzyl-3-hydroxy-5-phenyl-pentyl]-3-methyl-butyramide Formula: C25H35N3O3 MolecularWeight: 425.5637

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CC1=CC=CC=C1)CC(C(CC2=CC=CC=C2)N)O)NC(=O)C

Isomeric SMILES

CC(C)[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C[C@@H]([C@H](CC2=CC=CC=C2)N)O)NC(=O)C

InChI

InChI=1S/C25H35N3O3/c1-17(2)24(27-18(3)29)25(31)28-21(14-19-10-6-4-7-11-19)16-23(30)22(26)15-20-12-8-5-9-13-20/h4-13,17,21-24,30H,14-16,26H2,1-3H3,(H,27,29)(H,28,31)/t21-,22-,23-,24-/m0/s1