1-[(2R,6S)-2,6-dimethyl-4-[6-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyridin-2-yl]piperazin-1-yl]ethanone

Systemtic Name: 1-[(2R,6S)-2,6-dimethyl-4-[6-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyridin-2-yl]piperazin-1-yl]ethanone Openeye Name: 1-[(2R,6S)-2,6-dimethyl-4-[6-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)-2-pyridyl]piperazin-1-yl]ethanone CAS Name: 1-[(2R,6S)-2,6-dimethyl-4-[6-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)-2-pyridinyl]-1-piperazinyl]ethanone IUPAC Name: 1-[(2R,6S)-2,6-dimethyl-4-[6-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyridin-2-yl]piperazin-1-yl]ethanone Traditional Name: 1-[(2R,6S)-2,6-dimethyl-4-[6-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)-2-pyridyl]piperazino]ethanone Formula: C19H22N6O MolecularWeight: 350.41758

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1C(=O)C)C)C2=CC=CC(=N2)C3=CNC4=NC=NC=C34

Isomeric SMILES

C[C@@H]1CN(C[C@@H](N1C(=O)C)C)C2=CC=CC(=N2)C3=CNC4=NC=NC=C34

InChI

InChI=1S/C19H22N6O/c1-12-9-24(10-13(2)25(12)14(3)26)18-6-4-5-17(23-18)15-8-21-19-16(15)7-20-11-22-19/h4-8,11-13H,9-10H2,1-3H3,(H,20,21,22)/t12-,13+