7-azanyl-N-[3-(1H-indol-3-yl)-1-oxidanylidene-1-(4-phenylbutylamino)propan-2-yl]heptanamide

Systemtic Name: 7-azanyl-N-[3-(1H-indol-3-yl)-1-oxidanylidene-1-(4-phenylbutylamino)propan-2-yl]heptanamide Openeye Name: 7-amino-N-[1-(1H-indol-3-ylmethyl)-2-oxo-2-(4-phenylbutylamino)ethyl]heptanamide CAS Name: 7-amino-N-[3-(1H-indol-3-yl)-1-oxo-1-(4-phenylbutylamino)propan-2-yl]heptanamide IUPAC Name: 7-amino-N-[3-(1H-indol-3-yl)-1-oxo-1-(4-phenylbutylamino)propan-2-yl]heptanamide Traditional Name: 7-amino-N-[1-(1H-indol-3-ylmethyl)-2-keto-2-(4-phenylbutylamino)ethyl]enanthamide Formula: C28H38N4O2 MolecularWeight: 462.62692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CCCCCCN

Isomeric SMILES

C1=CC=C(C=C1)CCCCNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CCCCCCN

InChI

InChI=1S/C28H38N4O2/c29-18-10-2-1-6-17-27(33)32-26(20-23-21-31-25-16-8-7-15-24(23)25)28(34)30-19-11-9-14-22-12-4-3-5-13-22/h3-5,7-8,12-13,15-16,21,26,31H,1-2,6,9-11,14,17-20,29H2,(H,30,34)(H,32,33)