8-azanyl-N-[3-(1H-indol-3-yl)-1-oxidanylidene-1-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]propan-2-yl]octanamide

Systemtic Name: 8-azanyl-N-[3-(1H-indol-3-yl)-1-oxidanylidene-1-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]propan-2-yl]octanamide Openeye Name: 8-amino-N-[1-(1H-indol-3-ylmethyl)-2-oxo-2-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidyl]ethyl]octanamide CAS Name: 8-amino-N-[3-(1H-indol-3-yl)-1-oxo-1-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidinyl]propan-2-yl]octanamide IUPAC Name: 8-amino-N-[3-(1H-indol-3-yl)-1-oxo-1-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propan-2-yl]octanamide Traditional Name: 8-amino-N-[1-(1H-indol-3-ylmethyl)-2-keto-2-[4-(2-keto-3H-benzimidazol-1-yl)piperidino]ethyl]caprylamide Formula: C31H40N6O3 MolecularWeight: 544.6877

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=O)C(CC4=CNC5=CC=CC=C54)NC(=O)CCCCCCCN

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=O)C(CC4=CNC5=CC=CC=C54)NC(=O)CCCCCCCN

InChI

InChI=1S/C31H40N6O3/c32-17-9-3-1-2-4-14-29(38)34-27(20-22-21-33-25-11-6-5-10-24(22)25)30(39)36-18-15-23(16-19-36)37-28-13-8-7-12-26(28)35-31(37)40/h5-8,10-13,21,23,27,33H,1-4,9,14-20,32H2,(H,34,38)(H,35,40)