5-[(8-chloranylisoquinolin-3-yl)amino]-3-piperidin-3-yloxy-pyrazine-2-carbonitrile

Systemtic Name: 5-[(8-chloranylisoquinolin-3-yl)amino]-3-piperidin-3-yloxy-pyrazine-2-carbonitrile Openeye Name: 5-[(8-chloro-3-isoquinolyl)amino]-3-(3-piperidyloxy)pyrazine-2-carbonitrile CAS Name: 5-[(8-chloro-3-isoquinolinyl)amino]-3-(3-piperidinyloxy)-2-pyrazinecarbonitrile IUPAC Name: 5-[(8-chloroisoquinolin-3-yl)amino]-3-piperidin-3-yloxypyrazine-2-carbonitrile Traditional Name: 5-[(8-chloro-3-isoquinolyl)amino]-3-(3-piperidyloxy)pyrazinonitrile Formula: C19H17ClN6O MolecularWeight: 380.83088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)OC2=NC(=CN=C2C#N)NC3=NC=C4C(=C3)C=CC=C4Cl

Isomeric SMILES

C1CC(CNC1)OC2=NC(=CN=C2C#N)NC3=NC=C4C(=C3)C=CC=C4Cl

InChI

InChI=1S/C19H17ClN6O/c20-15-5-1-3-12-7-17(24-10-14(12)15)25-18-11-23-16(8-21)19(26-18)27-13-4-2-6-22-9-13/h1,3,5,7,10-11,13,22H,2,4,6,9H2,(H,24,25,26)