piperazin-1-yl-[3-[(7-pyridin-2-ylpyrrolo[2,3-d]pyrimidin-2-yl)amino]phenyl]methanone

Systemtic Name: piperazin-1-yl-[3-[(7-pyridin-2-ylpyrrolo[2,3-d]pyrimidin-2-yl)amino]phenyl]methanone Openeye Name: piperazin-1-yl-[3-[[7-(2-pyridyl)pyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]methanone CAS Name: 1-piperazinyl-[3-[[7-(2-pyridinyl)-2-pyrrolo[2,3-d]pyrimidinyl]amino]phenyl]methanone IUPAC Name: piperazin-1-yl-[3-[(7-pyridin-2-ylpyrrolo[2,3-d]pyrimidin-2-yl)amino]phenyl]methanone Traditional Name: piperazino-[3-[[7-(2-pyridyl)pyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]methanone Formula: C22H21N7O MolecularWeight: 399.44844

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C2=CC(=CC=C2)NC3=NC=C4C=CN(C4=N3)C5=CC=CC=N5

Isomeric SMILES

C1CN(CCN1)C(=O)C2=CC(=CC=C2)NC3=NC=C4C=CN(C4=N3)C5=CC=CC=N5

InChI

InChI=1S/C22H21N7O/c30-21(28-12-9-23-10-13-28)16-4-3-5-18(14-16)26-22-25-15-17-7-11-29(20(17)27-22)19-6-1-2-8-24-19/h1-8,11,14-15,23H,9-10,12-13H2,(H,25,26,27)