N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-3-(pyrimidin-2-ylamino)benzamide

Systemtic Name: N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-3-(pyrimidin-2-ylamino)benzamide Openeye Name: N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-3-(pyrimidin-2-ylamino)benzamide CAS Name: N-[2-(1H-indol-3-yl)-2-phenylethyl]-3-(2-pyrimidinylamino)benzamide IUPAC Name: N-[2-(1H-indol-3-yl)-2-phenylethyl]-3-(pyrimidin-2-ylamino)benzamide Traditional Name: N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-3-(2-pyrimidylamino)benzamide Formula: C27H23N5O MolecularWeight: 433.50442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNC(=O)C2=CC(=CC=C2)NC3=NC=CC=N3)C4=CNC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)C(CNC(=O)C2=CC(=CC=C2)NC3=NC=CC=N3)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C27H23N5O/c33-26(20-10-6-11-21(16-20)32-27-28-14-7-15-29-27)31-17-23(19-8-2-1-3-9-19)24-18-30-25-13-5-4-12-22(24)25/h1-16,18,23,30H,17H2,(H,31,33)(H,28,29,32)