ethyl 3-phenyl-3-[6-[3-(pyrimidin-2-ylamino)propoxy]-1H-indol-3-yl]propanoate

Systemtic Name: ethyl 3-phenyl-3-[6-[3-(pyrimidin-2-ylamino)propoxy]-1H-indol-3-yl]propanoate Openeye Name: ethyl 3-phenyl-3-[6-[3-(pyrimidin-2-ylamino)propoxy]-1H-indol-3-yl]propanoate CAS Name: 3-phenyl-3-[6-[3-(2-pyrimidinylamino)propoxy]-1H-indol-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-phenyl-3-[6-[3-(pyrimidin-2-ylamino)propoxy]-1H-indol-3-yl]propanoate Traditional Name: 3-phenyl-3-[6-[3-(2-pyrimidylamino)propoxy]-1H-indol-3-yl]propionic acid ethyl ester Formula: C26H28N4O3 MolecularWeight: 444.52552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC=CC=C1)C2=CNC3=C2C=CC(=C3)OCCCNC4=NC=CC=N4

Isomeric SMILES

CCOC(=O)CC(C1=CC=CC=C1)C2=CNC3=C2C=CC(=C3)OCCCNC4=NC=CC=N4

InChI

InChI=1S/C26H28N4O3/c1-2-32-25(31)17-22(19-8-4-3-5-9-19)23-18-30-24-16-20(10-11-21(23)24)33-15-7-14-29-26-27-12-6-13-28-26/h3-6,8-13,16,18,22,30H,2,7,14-15,17H2,1H3,(H,27,28,29)