(2S)-6-azanyl-2-[[(2S)-2-azanyl-3-phenyl-propanoyl]amino]-N-naphthalen-2-yl-hexanamide

Systemtic Name: (2S)-6-azanyl-2-[[(2S)-2-azanyl-3-phenyl-propanoyl]amino]-N-naphthalen-2-yl-hexanamide Openeye Name: (2S)-6-amino-2-[[(2S)-2-amino-3-phenyl-propanoyl]amino]-N-(2-naphthyl)hexanamide CAS Name: (2S)-6-amino-2-[[(2S)-2-amino-1-oxo-3-phenylpropyl]amino]-N-(2-naphthalenyl)hexanamide IUPAC Name: (2S)-6-amino-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-N-naphthalen-2-ylhexanamide Traditional Name: (2S)-6-amino-2-[[(2S)-2-amino-3-phenyl-propanoyl]amino]-N-(2-naphthyl)hexanamide Formula: C25H30N4O2 MolecularWeight: 418.5313

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC(CCCCN)C(=O)NC2=CC3=CC=CC=C3C=C2)N

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)N[C@@H](CCCCN)C(=O)NC2=CC3=CC=CC=C3C=C2)N

InChI

InChI=1S/C25H30N4O2/c26-15-7-6-12-23(29-24(30)22(27)16-18-8-2-1-3-9-18)25(31)28-21-14-13-19-10-4-5-11-20(19)17-21/h1-5,8-11,13-14,17,22-23H,6-7,12,15-16,26-27H2,(H,28,31)(H,29,30)/t22-,23-/m0/s1