5-(isoquinolin-3-ylamino)-3-piperidin-3-yloxy-pyrazine-2-carbonitrile

Systemtic Name: 5-(isoquinolin-3-ylamino)-3-piperidin-3-yloxy-pyrazine-2-carbonitrile Openeye Name: 5-(3-isoquinolylamino)-3-(3-piperidyloxy)pyrazine-2-carbonitrile CAS Name: 5-(3-isoquinolinylamino)-3-(3-piperidinyloxy)-2-pyrazinecarbonitrile IUPAC Name: 5-(isoquinolin-3-ylamino)-3-piperidin-3-yloxypyrazine-2-carbonitrile Traditional Name: 5-(3-isoquinolylamino)-3-(3-piperidyloxy)pyrazinonitrile Formula: C19H18N6O MolecularWeight: 346.38582

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)OC2=NC(=CN=C2C#N)NC3=CC4=CC=CC=C4C=N3

Isomeric SMILES

C1CC(CNC1)OC2=NC(=CN=C2C#N)NC3=CC4=CC=CC=C4C=N3

InChI

InChI=1S/C19H18N6O/c20-9-16-19(26-15-6-3-7-21-11-15)25-18(12-22-16)24-17-8-13-4-1-2-5-14(13)10-23-17/h1-2,4-5,8,10,12,15,21H,3,6-7,11H2,(H,23,24,25)