N-(2-cyanophenyl)-1-morpholin-4-yl-isoquinoline-4-carboxamide

Systemtic Name: N-(2-cyanophenyl)-1-morpholin-4-yl-isoquinoline-4-carboxamide Openeye Name: N-(2-cyanophenyl)-1-morpholino-isoquinoline-4-carboxamide CAS Name: N-(2-cyanophenyl)-1-(4-morpholinyl)-4-isoquinolinecarboxamide IUPAC Name: N-(2-cyanophenyl)-1-morpholin-4-ylisoquinoline-4-carboxamide Traditional Name: N-(2-cyanophenyl)-1-morpholino-isoquinoline-4-carboxamide Formula: C21H18N4O2 MolecularWeight: 358.39322

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC=C(C3=CC=CC=C32)C(=O)NC4=CC=CC=C4C#N

Isomeric SMILES

C1COCCN1C2=NC=C(C3=CC=CC=C32)C(=O)NC4=CC=CC=C4C#N

InChI

InChI=1S/C21H18N4O2/c22-13-15-5-1-4-8-19(15)24-21(26)18-14-23-20(25-9-11-27-12-10-25)17-7-3-2-6-16(17)18/h1-8,14H,9-12H2,(H,24,26)