3-(2,4-dimethoxypyrimidin-5-yl)-4-(1-phenethylpyrrolo[2,3-b]pyridin-3-yl)pyrrole-2,5-dione

Systemtic Name: 3-(2,4-dimethoxypyrimidin-5-yl)-4-(1-phenethylpyrrolo[2,3-b]pyridin-3-yl)pyrrole-2,5-dione Openeye Name: 3-(2,4-dimethoxypyrimidin-5-yl)-4-(1-phenethylpyrrolo[2,3-b]pyridin-3-yl)pyrrole-2,5-dione CAS Name: 3-(2,4-dimethoxy-5-pyrimidinyl)-4-(1-phenethyl-3-pyrrolo[2,3-b]pyridinyl)pyrrole-2,5-dione IUPAC Name: 3-(2,4-dimethoxypyrimidin-5-yl)-4-(1-phenethylpyrrolo[2,3-b]pyridin-3-yl)pyrrole-2,5-dione Traditional Name: 3-(2,4-dimethoxypyrimidin-5-yl)-4-(1-phenethylpyrrolo[2,3-b]pyridin-3-yl)-3-pyrroline-2,5-quinone Formula: C25H21N5O4 MolecularWeight: 455.46534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1C2=C(C(=O)NC2=O)C3=CN(C4=C3C=CC=N4)CCC5=CC=CC=C5)OC

Isomeric SMILES

COC1=NC(=NC=C1C2=C(C(=O)NC2=O)C3=CN(C4=C3C=CC=N4)CCC5=CC=CC=C5)OC

InChI

InChI=1S/C25H21N5O4/c1-33-24-17(13-27-25(29-24)34-2)19-20(23(32)28-22(19)31)18-14-30(21-16(18)9-6-11-26-21)12-10-15-7-4-3-5-8-15/h3-9,11,13-14H,10,12H2,1-2H3,(H,28,31,32)