N-[3-[(5-cyanopyrazin-2-yl)amino]isoquinolin-8-yl]-3-morpholin-4-yl-propanamide

Systemtic Name: N-[3-[(5-cyanopyrazin-2-yl)amino]isoquinolin-8-yl]-3-morpholin-4-yl-propanamide Openeye Name: N-[3-[(5-cyanopyrazin-2-yl)amino]-8-isoquinolyl]-3-morpholino-propanamide CAS Name: N-[3-[(5-cyano-2-pyrazinyl)amino]-8-isoquinolinyl]-3-(4-morpholinyl)propanamide IUPAC Name: N-[3-[(5-cyanopyrazin-2-yl)amino]isoquinolin-8-yl]-3-morpholin-4-ylpropanamide Traditional Name: N-[3-[(5-cyanopyrazin-2-yl)amino]-8-isoquinolyl]-3-morpholino-propionamide Formula: C21H21N7O2 MolecularWeight: 403.43714

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCC(=O)NC2=CC=CC3=CC(=NC=C32)NC4=NC=C(N=C4)C#N

Isomeric SMILES

C1COCCN1CCC(=O)NC2=CC=CC3=CC(=NC=C32)NC4=NC=C(N=C4)C#N

InChI

InChI=1S/C21H21N7O2/c22-11-16-12-24-20(14-23-16)27-19-10-15-2-1-3-18(17(15)13-25-19)26-21(29)4-5-28-6-8-30-9-7-28/h1-3,10,12-14H,4-9H2,(H,26,29)(H,24,25,27)