5-[(8-chloranylisoquinolin-3-yl)amino]-3-(1-methylpiperidin-3-yl)oxy-pyrazine-2-carbonitrile

Systemtic Name: 5-[(8-chloranylisoquinolin-3-yl)amino]-3-(1-methylpiperidin-3-yl)oxy-pyrazine-2-carbonitrile Openeye Name: 5-[(8-chloro-3-isoquinolyl)amino]-3-[(1-methyl-3-piperidyl)oxy]pyrazine-2-carbonitrile CAS Name: 5-[(8-chloro-3-isoquinolinyl)amino]-3-[(1-methyl-3-piperidinyl)oxy]-2-pyrazinecarbonitrile IUPAC Name: 5-[(8-chloroisoquinolin-3-yl)amino]-3-(1-methylpiperidin-3-yl)oxypyrazine-2-carbonitrile Traditional Name: 5-[(8-chloro-3-isoquinolyl)amino]-3-[(1-methyl-3-piperidyl)oxy]pyrazinonitrile Formula: C20H19ClN6O MolecularWeight: 394.85746

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1)OC2=NC(=CN=C2C#N)NC3=NC=C4C(=C3)C=CC=C4Cl

Isomeric SMILES

CN1CCCC(C1)OC2=NC(=CN=C2C#N)NC3=NC=C4C(=C3)C=CC=C4Cl

InChI

InChI=1S/C20H19ClN6O/c1-27-7-3-5-14(12-27)28-20-17(9-22)23-11-19(26-20)25-18-8-13-4-2-6-16(21)15(13)10-24-18/h2,4,6,8,10-11,14H,3,5,7,12H2,1H3,(H,24,25,26)