N-[3-cyano-1-(2-ethylhexyl)pyrrolo[3,2-b]quinoxalin-2-yl]propanamide

Systemtic Name: N-[3-cyano-1-(2-ethylhexyl)pyrrolo[3,2-b]quinoxalin-2-yl]propanamide Openeye Name: N-[3-cyano-1-(2-ethylhexyl)pyrrolo[3,2-b]quinoxalin-2-yl]propanamide CAS Name: N-[3-cyano-1-(2-ethylhexyl)-2-pyrrolo[3,2-b]quinoxalinyl]propanamide IUPAC Name: N-[3-cyano-1-(2-ethylhexyl)pyrrolo[3,2-b]quinoxalin-2-yl]propanamide Traditional Name: N-[3-cyano-1-(2-ethylhexyl)pyrrolo[3,2-b]quinoxalin-2-yl]propionamide Formula: C22H27N5O MolecularWeight: 377.48268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CN1C(=C(C2=NC3=CC=CC=C3N=C21)C#N)NC(=O)CC

Isomeric SMILES

CCCCC(CC)CN1C(=C(C2=NC3=CC=CC=C3N=C21)C#N)NC(=O)CC

InChI

InChI=1S/C22H27N5O/c1-4-7-10-15(5-2)14-27-21(26-19(28)6-3)16(13-23)20-22(27)25-18-12-9-8-11-17(18)24-20/h8-9,11-12,15H,4-7,10,14H2,1-3H3,(H,26,28)