(2S)-N-(4-azanylbutyl)-6-(1H-indol-3-ylmethylamino)-2-(naphthalen-2-ylmethylamino)hexanamide

Systemtic Name: (2S)-N-(4-azanylbutyl)-6-(1H-indol-3-ylmethylamino)-2-(naphthalen-2-ylmethylamino)hexanamide Openeye Name: (2S)-N-(4-aminobutyl)-6-(1H-indol-3-ylmethylamino)-2-(2-naphthylmethylamino)hexanamide CAS Name: (2S)-N-(4-aminobutyl)-6-(1H-indol-3-ylmethylamino)-2-(2-naphthalenylmethylamino)hexanamide IUPAC Name: (2S)-N-(4-aminobutyl)-6-(1H-indol-3-ylmethylamino)-2-(naphthalen-2-ylmethylamino)hexanamide Traditional Name: (2S)-N-(4-aminobutyl)-6-(1H-indol-3-ylmethylamino)-2-(2-naphthylmethylamino)hexanamide Formula: C30H39N5O MolecularWeight: 485.66356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CNC(CCCCNCC3=CNC4=CC=CC=C43)C(=O)NCCCCN

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CN[C@@H](CCCCNCC3=CNC4=CC=CC=C43)C(=O)NCCCCN

InChI

InChI=1S/C30H39N5O/c31-16-6-8-18-33-30(36)29(34-20-23-14-15-24-9-1-2-10-25(24)19-23)13-5-7-17-32-21-26-22-35-28-12-4-3-11-27(26)28/h1-4,9-12,14-15,19,22,29,32,34-35H,5-8,13,16-18,20-21,31H2,(H,33,36)/t29-/m0/s1