N-[(1R)-2-(1H-indol-3-yl)-1-[4-[(4-methoxyphenyl)methyl]-5-phenethyl-1,2,4-triazol-3-yl]ethyl]-3-pyridin-3-yl-propanamide

Systemtic Name: N-[(1R)-2-(1H-indol-3-yl)-1-[4-[(4-methoxyphenyl)methyl]-5-phenethyl-1,2,4-triazol-3-yl]ethyl]-3-pyridin-3-yl-propanamide Openeye Name: N-[(1R)-2-(1H-indol-3-yl)-1-[4-[(4-methoxyphenyl)methyl]-5-phenethyl-1,2,4-triazol-3-yl]ethyl]-3-(3-pyridyl)propanamide CAS Name: N-[(1R)-2-(1H-indol-3-yl)-1-[4-[(4-methoxyphenyl)methyl]-5-phenethyl-1,2,4-triazol-3-yl]ethyl]-3-(3-pyridinyl)propanamide IUPAC Name: N-[(1R)-2-(1H-indol-3-yl)-1-[4-[(4-methoxyphenyl)methyl]-5-phenethyl-1,2,4-triazol-3-yl]ethyl]-3-pyridin-3-ylpropanamide Traditional Name: N-[(1R)-2-(1H-indol-3-yl)-1-(4-p-anisyl-5-phenethyl-1,2,4-triazol-3-yl)ethyl]-3-(3-pyridyl)propionamide Formula: C36H36N6O2 MolecularWeight: 584.71004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=NN=C2C(CC3=CNC4=CC=CC=C43)NC(=O)CCC5=CN=CC=C5)CCC6=CC=CC=C6

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=NN=C2[C@@H](CC3=CNC4=CC=CC=C43)NC(=O)CCC5=CN=CC=C5)CCC6=CC=CC=C6

InChI

InChI=1S/C36H36N6O2/c1-44-30-17-13-28(14-18-30)25-42-34(19-15-26-8-3-2-4-9-26)40-41-36(42)33(22-29-24-38-32-12-6-5-11-31(29)32)39-35(43)20-16-27-10-7-21-37-23-27/h2-14,17-18,21,23-24,33,38H,15-16,19-20,22,25H2,1H3,(H,39,43)/t33-/m1/s1