ethyl 4-[[6-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-4-yl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[6-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-4-yl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[6-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-4-yl]amino]piperidine-1-carboxylate CAS Name: 4-[[6-(1H-pyrrolo[2,3-b]pyridin-3-yl)-4-pyrimidinyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[6-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-4-yl]amino]piperidine-1-carboxylate Traditional Name: 4-[[6-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-4-yl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C19H22N6O2 MolecularWeight: 366.41698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC2=NC=NC(=C2)C3=CNC4=C3C=CC=N4

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC2=NC=NC(=C2)C3=CNC4=C3C=CC=N4

InChI

InChI=1S/C19H22N6O2/c1-2-27-19(26)25-8-5-13(6-9-25)24-17-10-16(22-12-23-17)15-11-21-18-14(15)4-3-7-20-18/h3-4,7,10-13H,2,5-6,8-9H2,1H3,(H,20,21)(H,22,23,24)