3-(8-chloranylisoquinolin-3-yl)-5-(1-piperidin-4-ylpyrazol-4-yl)pyridin-2-amine

Systemtic Name: 3-(8-chloranylisoquinolin-3-yl)-5-(1-piperidin-4-ylpyrazol-4-yl)pyridin-2-amine Openeye Name: 3-(8-chloro-3-isoquinolyl)-5-[1-(4-piperidyl)pyrazol-4-yl]pyridin-2-amine CAS Name: 3-(8-chloro-3-isoquinolinyl)-5-[1-(4-piperidinyl)-4-pyrazolyl]-2-pyridinamine IUPAC Name: 3-(8-chloroisoquinolin-3-yl)-5-(1-piperidin-4-ylpyrazol-4-yl)pyridin-2-amine Traditional Name: [3-(8-chloro-3-isoquinolyl)-5-[1-(4-piperidyl)pyrazol-4-yl]-2-pyridyl]amine Formula: C22H21ClN6 MolecularWeight: 404.89534

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1N2C=C(C=N2)C3=CC(=C(N=C3)N)C4=NC=C5C(=C4)C=CC=C5Cl

Isomeric SMILES

C1CNCCC1N2C=C(C=N2)C3=CC(=C(N=C3)N)C4=NC=C5C(=C4)C=CC=C5Cl

InChI

InChI=1S/C22H21ClN6/c23-20-3-1-2-14-9-21(26-12-19(14)20)18-8-15(10-27-22(18)24)16-11-28-29(13-16)17-4-6-25-7-5-17/h1-3,8-13,17,25H,4-7H2,(H2,24,27)