(phenylmethyl) 4-[8-azanyl-1-(2-pyridin-3-ylethynyl)imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[8-azanyl-1-(2-pyridin-3-ylethynyl)imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylate Openeye Name: benzyl 4-[8-amino-1-[2-(3-pyridyl)ethynyl]imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylate CAS Name: 4-[8-amino-1-[2-(3-pyridinyl)ethynyl]-3-imidazo[1,5-a]pyrazinyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[8-amino-1-(2-pyridin-3-ylethynyl)imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylate Traditional Name: 4-[8-amino-1-[2-(3-pyridyl)ethynyl]imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylic acid benzyl ester Formula: C26H24N6O2 MolecularWeight: 452.50776

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=C3N2C=CN=C3N)C#CC4=CN=CC=C4)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C2=NC(=C3N2C=CN=C3N)C#CC4=CN=CC=C4)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C26H24N6O2/c27-24-23-22(9-8-19-7-4-12-28-17-19)30-25(32(23)16-13-29-24)21-10-14-31(15-11-21)26(33)34-18-20-5-2-1-3-6-20/h1-7,12-13,16-17,21H,10-11,14-15,18H2,(H2,27,29)