3-[6-methoxy-3-(1H-pyrazol-5-ylamino)isoquinolin-1-yl]benzenecarbonitrile

Systemtic Name: 3-[6-methoxy-3-(1H-pyrazol-5-ylamino)isoquinolin-1-yl]benzenecarbonitrile Openeye Name: 3-[6-methoxy-3-(1H-pyrazol-5-ylamino)-1-isoquinolyl]benzonitrile CAS Name: 3-[6-methoxy-3-(1H-pyrazol-5-ylamino)-1-isoquinolinyl]benzonitrile IUPAC Name: 3-[6-methoxy-3-(1H-pyrazol-5-ylamino)isoquinolin-1-yl]benzonitrile Traditional Name: 3-[6-methoxy-3-(1H-pyrazol-5-ylamino)-1-isoquinolyl]benzonitrile Formula: C20H15N5O MolecularWeight: 341.366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC(=NC(=C2C=C1)C3=CC=CC(=C3)C#N)NC4=CC=NN4

Isomeric SMILES

COC1=CC2=CC(=NC(=C2C=C1)C3=CC=CC(=C3)C#N)NC4=CC=NN4

InChI

InChI=1S/C20H15N5O/c1-26-16-5-6-17-15(10-16)11-19(23-18-7-8-22-25-18)24-20(17)14-4-2-3-13(9-14)12-21/h2-11H,1H3,(H2,22,23,24,25)